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authorChristoph Helma <helma@in-silico.de>2009-10-06 09:49:42 +0200
committerChristoph Helma <helma@in-silico.de>2009-10-06 09:49:42 +0200
commit113fbed358d5762d6f7210d67ea1fea0a8aac200 (patch)
tree3675e03113fe14ade5fff1d35622f787e8e82e9d
Initial import of OpenTox tests
Diffstat
-rw-r--r--.gitignore1
-rw-r--r--Rakefile11
-rw-r--r--features/compound.feature17
-rw-r--r--features/data/hamster_carcinogenicity.csv85
-rw-r--r--features/data/hamster_carcinogenicity_bbrc_features.yaml1740
-rw-r--r--features/data/kazius.csv4069
-rw-r--r--features/dataset.feature39
-rw-r--r--features/dataset_large.feature15
-rw-r--r--features/feature.feature13
-rw-r--r--features/fminer.feature16
-rw-r--r--features/lazar.feature17
-rw-r--r--features/step_definitions/.lazar_steps.rb.swpbin0 -> 12288 bytes
-rw-r--r--features/step_definitions/common_steps.rb24
-rw-r--r--features/step_definitions/dataset_steps.rb26
-rw-r--r--features/step_definitions/fminer_step.rb7
-rw-r--r--features/step_definitions/lazar_steps.rb18
-rw-r--r--features/support/env.rb5
-rw-r--r--features/support/hooks.rb14
18 files changed, 6117 insertions, 0 deletions
diff --git a/.gitignore b/.gitignore
new file mode 100644
index 0000000..24ebcf5
--- /dev/null
+++ b/.gitignore
@@ -0,0 +1 @@
+dump.rdb
diff --git a/Rakefile b/Rakefile
new file mode 100644
index 0000000..134c078
--- /dev/null
+++ b/Rakefile
@@ -0,0 +1,11 @@
+require 'rubygems'
+require 'cucumber'
+require 'cucumber/rake/task'
+require 'tasks/opentox'
+
+task :default => :features
+
+Cucumber::Rake::Task.new(:features) do |t|
+ t.cucumber_opts = "features --format pretty"
+end
+
diff --git a/features/compound.feature b/features/compound.feature
new file mode 100644
index 0000000..2bc443c
--- /dev/null
+++ b/features/compound.feature
@@ -0,0 +1,17 @@
+@rest
+Feature: Create URI
+
+ Scenario Outline: Create and get URIs
+ Given <type> is <descriptor>
+ When I post the parameters to the compound webservice
+ Then I should receive a valid URI
+ And the URI should contain <inchi>
+ And the URI response should be <cansmi>
+
+ Examples:
+ |descriptor |type |inchi |cansmi |
+ |CC(=O)CC(C)C#N |smiles|InChI=1S/C6H9NO/c1-5(4-7)3-6(2)8/h5H,3H2,1-2H3 |CC(CC(=O)C)C#N |
+ |Benzene |name |InChI=1S/C6H6/c1-2-4-6-5-3-1/h1-6H |c1ccccc1 |
+ |F[B-](F)(F)F.[Na+] |smiles|InChI=1S/BF4.Na/c2-1(3,4)5;/q-1;+1 |[Na+].F[B-](F)(F)F |
+ |N#[N+]C1=CC=CC=C1.F[B-](F)(F)F |smiles|InChI=1S/C6H5N2.BF4/c7-8-6-4-2-1-3-5-6;2-1(3,4)5/h1-5H;/q+1;-1|N#[N+]c1ccccc1.F[B-](F)(F)F|
+ |InChI=1S/C6H6/c1-2-4-6-5-3-1/h1-6H|inchi |InChI=1S/C6H6/c1-2-4-6-5-3-1/h1-6H |c1ccccc1 |
diff --git a/features/data/hamster_carcinogenicity.csv b/features/data/hamster_carcinogenicity.csv
new file mode 100644
index 0000000..009808f
--- /dev/null
+++ b/features/data/hamster_carcinogenicity.csv
@@ -0,0 +1,85 @@
+CC=O,true
+C12C3=C(C=CC=C3)CC1=CC(=CC=2)NC(C)=O,true
+O=C(N)\C(C2=CC=CO2)=C/C1=CC=C([N+]([O-])=O)O1,true
+C1(N=CNN=1)N,false
+Br(=O)(=O)[O-].[K+],true
+[Cl-].[Cd+2].[Cl-],false
+O=S(=O)([O-])[O-].[Cd+2],false
+ClC1=CC(=NC(=N1)SCC(=O)O)NC2=CC=CC(=C2C)C,false
+ClCOC,true
+C=C(Cl)C=C,false
+Clc1ccc(cc1)c2ccc(COC(C)(C)C(O)=O)cc2,false
+O=C1OC2=C(C=CC=C2)C=C1,false
+ClC(=C(C1=CC=C(C=C1)Cl)C2=CC=C(C=C2)Cl)Cl,true
+ClC(C(C1=CC=C(C=C1)Cl)C2=CC=C(C=C2)Cl)(Cl)Cl,false
+C=CCN(CC=C)N=O,true
+Cl\C2=C(/Cl)C3(Cl)C1C4CC(C1C2(Cl)C3(Cl)Cl)C5OC45,false
+O=C(N(C)C)Cl,true
+CN(C)N,true
+N(NC)C.[H]Cl.[H]Cl,true
+CCO,false
+O=C(N(CC)N=O)NCCO,true
+O=C(N(CC)N=O)NCC(=O)C,true
+C=O,false
+[O-][N+](=O)C1=CC=C(O1)C2=CSC(=N2)NNC=O,true
+O=CC1=CC=CO1,false
+OCC1CO1,true
+O=C2C1=C(OC)C=C(OC)C(Cl)=C1O[C@]32C(OC)=CC(C[C@@](C)3[H])=O,false
+ClC1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl,true
+NN,true
+OS(=O)(=O)O.NN,true
+CC(=O)N(O)C1=CC2=C(C=C1)C3=CC=CC=C3C2,true
+OCCNN,false
+O=C(C1=CC=NC=C1)NN,false
+OC(=O)C1=CC=NC=C1,false
+O=C(NC1=CC=CC(=C1)Cl)OC(C)C,false
+O=C(NC1=CC=CC=C1)OC(C)C,false
+[O-]C(C)=O.[O-]C(C)=O.[Pb+2].[OH-].[OH-].[Pb+2].[OH-].[OH-].[Pb+2],false
+CN(C)CCN(CC2=CC=CS2)C1=NC=CC=C1.Cl,false
+NC1=C2C(=NC(=N1)N)N=CC(=N2)CN(C3=CC=C(C=C3)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C,false
+CN(N)C=O,true
+O=C(C(=C)C)OC,false
+CNN,true
+O=C(C1=CC=CN=C1)CCCN(N=O)C,false
+CC1=CC(=O)NC(=S)N1,true
+CC(C(O)=O)(OC1=CC=C(C=C1)C2CCCC3=C2C=CC=C3)C,false
+O=N[O-].[Na+],false
+[O-][N+](C1=CC=C(C2=CSC(NC(C)=O)=N2)O1)=O,true
+[O-][N+](=O)C1=CC=C(O1)C2=CSC(=N2)NC=O,true
+O=[N+](C1=CC=C2C3=C1C=CC=C3CC2)[O-],false
+N(CC(CO)O)(CC(O)C)N=O,true
+N(CC(CO)O)(CC(C)=O)N=O,true
+N(CC(CO)O)(CCO)N=O,false
+O=C(C)CN(N=O)CCO,true
+C1C(N(C(CN1N=O)C)C)C,true
+N(CC(C)=O)(CC=C)N=O,true
+N(CC(CO)O)(C)N=O,true
+O=NN1CCOCC1,true
+N1C=CC=C(C=1)C2N(N=O)CCC2,true
+C1=CC=C(C=[N+]1[O-])C2CCCN2N=O,false
+O=NN1CCCCC1,true
+O=NN1CCCC1,true
+O=C(N(CC(C)=O)N=O)NCCCl,true
+N(C(=O)N)(N=O)CC(C)=O,true
+C1(CCN=C=S)=CC=CC=C1,false
+O=C1C(C2=CC=CC=C2)(C(=O)NC(=O)N1)CC,false
+C1=C2C(=CC=C1NC3=CC=CC=C3)C=CC=C2,false
+O=C1N2C(C3=C(C=CC=C3)CC2)CN(C1)C(=O)C4CCCCC4,false
+C1(=CC(=C(O)C=C1)O)C(O)=O,false
+O=C1C2=C(C=C(C=C2O)O)O/C(=C\1O)C3=CC(=C(C=C3)O)O.O.O,false
+C1=C(C=CC(=C1)C(C2=CC=C(N)C(=C2)C)=C3C=CC(=N)C=C3)N.[H]Cl,false
+C(C1=CC=C(C=C1)N)(C2=CC=C(C=C2)N)=C3C=CC(C=C3)=N.[H]Cl,false
+OC2=CC1=C(C(O)=C2)C(C(O[C@@H]4O[C@@H]([C@H]([C@H](O)[C@H]4O)O)CO[C@H]3[C@H](O)[C@H](O)[C@H]([C@H](C)O3)O)=C(C5=CC(O)=C(C=C5)O)O1)=O,false
+ClC(=CCl)Cl,false
+NC(=O)OCC,true
+C=CCl,true
+N#[N+]C1=CC=CC=C1.F[B-](F)(F)F,false
+C1(CN(CC(N1N=O)C)N=O)C,true
+N(CCN(C)C)(C)N=O,true
+C1(CN(N=O)CC(O1)C)C,true
+O1C(N(CC1C)N=O)=O,true
+CCOC(=O)N(C)N=O,true
+C1N(COC1)N=O,true
+O=C(N(CCC1=CC=CC=C1)N=O)N,true
+O=NN1CCC1,true
+F[B-](F)(F)F.[Na+],false
diff --git a/features/data/hamster_carcinogenicity_bbrc_features.yaml b/features/data/hamster_carcinogenicity_bbrc_features.yaml
new file mode 100644
index 0000000..5cc3d2f
--- /dev/null
+++ b/features/data/hamster_carcinogenicity_bbrc_features.yaml
@@ -0,0 +1,1740 @@
+---
+http://localhost:4000/InChI=1S/2C2H4O2.4H2O.3Pb/c2*1-2(3)4;;;;;;;/h2*1H3,(H,3,4);4*1H2;;;/q;;;;;;3*+2/p-6:
+- http://localhost:4001/O-C=O/p_value/0.9792/effect/deactivating
+- http://localhost:4001/C-C(=O)(-O)/p_value/0.9985/effect/deactivating
+http://localhost:4000/InChI=1S/C3H6O2/c4-1-3-2-5-3/h3-4H,1-2H2:
+- http://localhost:4001/C-C-C-O/p_value/0.9675/effect/deactivating
+http://localhost:4000/InChI=1S/C20H22N8O5/c1-28(9-11-8-23-17-15(24-11)16(21)26-20(22)27-17)12-4-2-10(3-5-12)18(31)25-13(19(32)33)6-7-14(29)30/h2-5,8,13H,6-7,9H2,1H3,(H,25,31)(H,29,30)(H,32,33)(H4,21,22,23,26,27)/t13-/m0/s1:
+- http://localhost:4001/O-C=O/p_value/0.9792/effect/deactivating
+- http://localhost:4001/C-C(=O)(-O)/p_value/0.9985/effect/deactivating
+- http://localhost:4001/O=C-C-N-C=O/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C-C-C-N-C=O/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(=O)(-N-C-C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-N-C=O)(-C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-N-C(=O)(-C))(-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-N-C=O)(-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C=C-C=O/p_value/0.9996/effect/deactivating
+- http://localhost:4001/C-C-C=O/p_value/0.9998/effect/deactivating
+- http://localhost:4001/N-C-C-O/p_value/0.9669/effect/activating
+- http://localhost:4001/C-C-C-O/p_value/0.9675/effect/deactivating
+- http://localhost:4001/C-C-C-C-O/p_value/0.9908/effect/deactivating
+- http://localhost:4001/N-C=N-C=N/p_value/0.8949/effect/deactivating
+- http://localhost:4001/N-C(-N=C)(=N)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C=N-C=C/p_value/0.9367/effect/deactivating
+- http://localhost:4001/N-C-N=C/p_value/0.9417/effect/deactivating
+- http://localhost:4001/N-C-N=C-N/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(=N-C)(-N)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/N-C-N=C-C/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C-C=N-C/p_value/0.8949/effect/deactivating
+- http://localhost:4001/N-C(=N)(-N)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(=N)(-N)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/C=C-C=C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C=C)/p_value/0.9986/effect/deactivating
+- http://localhost:4001/C-C-C=C/p_value/0.9981/effect/deactivating
+- http://localhost:4001/C-C=C-C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C)/p_value/0.9991/effect/deactivating
+- http://localhost:4001/C-N-C/p_value/0.9961/effect/activating
+- http://localhost:4001/N-C-N/p_value/0.9417/effect/deactivating
+- http://localhost:4001/N=C-C/p_value/0.8735/effect/deactivating
+- http://localhost:4001/C-C-C-C/p_value/0.9874/effect/deactivating
+http://localhost:4000/InChI=1S/BF4.Na/c2-1(3,4)5;/q-1;+1:
+- http://localhost:4001/B-F/p_value/0.8949/effect/deactivating
+http://localhost:4000/InChI=1S/H4N2/c1-2/h1-2H2:
+- http://localhost:4001/N-N/p_value/0.9998/effect/activating
+http://localhost:4000/InChI=1S/C19H17N3.ClH/c20-16-7-1-13(2-8-16)19(14-3-9-17(21)10-4-14)15-5-11-18(22)12-6-15;/h1-12,20H,21-22H2;1H:
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/C=C-C=C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C=C)/p_value/0.9986/effect/deactivating
+- http://localhost:4001/C-C-C=C/p_value/0.9981/effect/deactivating
+- http://localhost:4001/C-C=C-C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C)/p_value/0.9991/effect/deactivating
+- http://localhost:4001/N=C-C/p_value/0.8735/effect/deactivating
+- http://localhost:4001/C-C-C-C/p_value/0.9874/effect/deactivating
+http://localhost:4000/InChI=1S/C6Cl6/c7-1-2(8)4(10)6(12)5(11)3(1)9:
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/C=C-C=C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C=C-C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/Cl-C-C/p_value/0.7721/effect/deactivating
+http://localhost:4000/InChI=1S/C3H6N2O2/c6-4-5-1-2-7-3-5/h1-3H2:
+- http://localhost:4001/N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-C-O/p_value/0.9994/effect/activating
+- http://localhost:4001/N-C-C-O/p_value/0.9669/effect/activating
+- http://localhost:4001/C-N(-C-C-O)(-N)/p_value/0.9726/effect/activating
+- http://localhost:4001/N-C-O-C/p_value/0.9891/effect/activating
+- http://localhost:4001/N-C-C-O-C/p_value/0.9891/effect/activating
+- http://localhost:4001/N-C-O-C-C/p_value/0.9891/effect/activating
+- http://localhost:4001/N-N-C/p_value/0.9994/effect/activating
+- http://localhost:4001/C-N(-C)(-N)/p_value/0.9999/effect/activating
+- http://localhost:4001/C-N-C/p_value/0.9961/effect/activating
+- http://localhost:4001/N-N-C-C/p_value/0.9972/effect/activating
+- http://localhost:4001/C-N(-C-C)(-N)/p_value/0.9996/effect/activating
+- http://localhost:4001/N-N/p_value/0.9998/effect/activating
+http://localhost:4000/InChI=1S/C10H13NO2/c1-8(2)13-10(12)11-9-6-4-3-5-7-9/h3-8H,1-2H3,(H,11,12):
+- http://localhost:4001/N=C-O/p_value/0.9495/effect/activating
+- http://localhost:4001/O-C-O/p_value/0.7696/effect/deactivating
+- http://localhost:4001/C-C(-O-C-O)(-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-N=C-O-C/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-O-C(=N)(-O))(-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-O-C=N)(-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C=C-N=C/p_value/0.9136/effect/deactivating
+- http://localhost:4001/C=C-C=C-N=C/p_value/0.9636/effect/deactivating
+- http://localhost:4001/C-C=C-C=C-C-N=C/p_value/0.7696/effect/deactivating
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/C=C-C=C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C=C-C/p_value/0.9984/effect/deactivating
+http://localhost:4000/InChI=1S/C6H10N2O2/c1-3-4-8(7-10)5-6(2)9/h3H,1,4-5H2,2H3:
+- http://localhost:4001/N-N-C-C=O/p_value/0.9708/effect/activating
+- http://localhost:4001/C-C(=O)(-C-N-C)/p_value/0.9708/effect/activating
+- http://localhost:4001/C-C(=O)(-C-N)/p_value/0.9822/effect/activating
+- http://localhost:4001/N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/N-N-C/p_value/0.9994/effect/activating
+- http://localhost:4001/C-N(-C)(-N)/p_value/0.9999/effect/activating
+- http://localhost:4001/C-N-C/p_value/0.9961/effect/activating
+- http://localhost:4001/N-N-C-C/p_value/0.9972/effect/activating
+- http://localhost:4001/C-N(-C-C)(-N)/p_value/0.9996/effect/activating
+- http://localhost:4001/N-N-C-C-C/p_value/0.9856/effect/activating
+- http://localhost:4001/C-N(-C-C-C)(-N)/p_value/0.9909/effect/activating
+- http://localhost:4001/N-N/p_value/0.9998/effect/activating
+http://localhost:4000/InChI=1S/C4H8N2O/c7-5-6-3-1-2-4-6/h1-4H2:
+- http://localhost:4001/N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-N-C/p_value/0.9994/effect/activating
+- http://localhost:4001/C-N(-C)(-N)/p_value/0.9999/effect/activating
+- http://localhost:4001/C-N-C/p_value/0.9961/effect/activating
+- http://localhost:4001/N-N-C-C/p_value/0.9972/effect/activating
+- http://localhost:4001/C-N(-C-C)(-N)/p_value/0.9996/effect/activating
+- http://localhost:4001/N-N-C-C-C/p_value/0.9856/effect/activating
+- http://localhost:4001/C-N(-C-C-C)(-N)/p_value/0.9909/effect/activating
+- http://localhost:4001/C-C-C-C/p_value/0.9874/effect/deactivating
+- http://localhost:4001/N-N/p_value/0.9998/effect/activating
+http://localhost:4000/InChI=1S/C5H10N2O/c8-6-7-4-2-1-3-5-7/h1-5H2:
+- http://localhost:4001/N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-N-C/p_value/0.9994/effect/activating
+- http://localhost:4001/C-N(-C)(-N)/p_value/0.9999/effect/activating
+- http://localhost:4001/C-N-C/p_value/0.9961/effect/activating
+- http://localhost:4001/N-N-C-C/p_value/0.9972/effect/activating
+- http://localhost:4001/C-N(-C-C)(-N)/p_value/0.9996/effect/activating
+- http://localhost:4001/N-N-C-C-C/p_value/0.9856/effect/activating
+- http://localhost:4001/C-N(-C-C-C)(-N)/p_value/0.9909/effect/activating
+- http://localhost:4001/C-C-C-C/p_value/0.9874/effect/deactivating
+- http://localhost:4001/N-N/p_value/0.9998/effect/activating
+http://localhost:4000/InChI=1S/C6H12N2O2/c1-5-3-8(7-9)4-6(2)10-5/h5-6H,3-4H2,1-2H3:
+- http://localhost:4001/N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-C-C-O/p_value/0.9669/effect/activating
+- http://localhost:4001/C-N(-C-C-O)(-N)/p_value/0.9726/effect/activating
+- http://localhost:4001/N-C-C-O-C/p_value/0.9891/effect/activating
+- http://localhost:4001/C-C-O-C-C/p_value/0.9367/effect/deactivating
+- http://localhost:4001/N-N-C/p_value/0.9994/effect/activating
+- http://localhost:4001/C-N(-C)(-N)/p_value/0.9999/effect/activating
+- http://localhost:4001/C-N-C/p_value/0.9961/effect/activating
+- http://localhost:4001/N-N-C-C/p_value/0.9972/effect/activating
+- http://localhost:4001/C-N(-C-C)(-N)/p_value/0.9996/effect/activating
+- http://localhost:4001/N-N-C-C-C/p_value/0.9856/effect/activating
+- http://localhost:4001/C-N(-C-C-C)(-N)/p_value/0.9909/effect/activating
+- http://localhost:4001/N-N/p_value/0.9998/effect/activating
+http://localhost:4000/InChI=1S/C6H14N2O4/c1-5(10)2-8(7-12)3-6(11)4-9/h5-6,9-11H,2-4H2,1H3:
+- http://localhost:4001/N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-C-C-O/p_value/0.9669/effect/activating
+- http://localhost:4001/C-N(-C-C-O)(-N)/p_value/0.9726/effect/activating
+- http://localhost:4001/C-C-C-O/p_value/0.9675/effect/deactivating
+- http://localhost:4001/N-N-C/p_value/0.9994/effect/activating
+- http://localhost:4001/C-N(-C)(-N)/p_value/0.9999/effect/activating
+- http://localhost:4001/C-N-C/p_value/0.9961/effect/activating
+- http://localhost:4001/N-N-C-C/p_value/0.9972/effect/activating
+- http://localhost:4001/C-N(-C-C)(-N)/p_value/0.9996/effect/activating
+- http://localhost:4001/N-N-C-C-C/p_value/0.9856/effect/activating
+- http://localhost:4001/C-N(-C-C-C)(-N)/p_value/0.9909/effect/activating
+- http://localhost:4001/N-N/p_value/0.9998/effect/activating
+http://localhost:4000/InChI=1S/C17H17ClO3/c1-17(2,16(19)20)21-11-12-3-5-13(6-4-12)14-7-9-15(18)10-8-14/h3-10H,11H2,1-2H3,(H,19,20):
+- http://localhost:4001/O-C=O/p_value/0.9792/effect/deactivating
+- http://localhost:4001/C-C(=O)(-O)/p_value/0.9985/effect/deactivating
+- http://localhost:4001/O-C-C=O/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C-C-C=O/p_value/0.9998/effect/deactivating
+- http://localhost:4001/C-C-O-C-C-O/p_value/0.9685/effect/deactivating
+- http://localhost:4001/C-C(-C-O)(-O-C)/p_value/0.9685/effect/deactivating
+- http://localhost:4001/C-C(-O)(-C-O)(-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C=C-C-O/p_value/0.9882/effect/deactivating
+- http://localhost:4001/C-C(-C-O)(=C)/p_value/0.9882/effect/deactivating
+- http://localhost:4001/C-C-C-O/p_value/0.9675/effect/deactivating
+- http://localhost:4001/C-C=C-C=C-C-C-O/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C-C(-C-O)(-C)/p_value/0.983/effect/deactivating
+- http://localhost:4001/C-C(-O)(-C)(-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C=C-C-O-C/p_value/0.9608/effect/deactivating
+- http://localhost:4001/C-C-C=C-C=C-C-O-C/p_value/0.9685/effect/deactivating
+- http://localhost:4001/C-C-O-C-C=C-C=C/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C=C-C(-C-O-C)(=C-C=C)/p_value/0.9685/effect/deactivating
+- http://localhost:4001/C=C-C(-C-O-C)(=C-C)/p_value/0.9685/effect/deactivating
+- http://localhost:4001/C-C-O-C-C=C/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C-C(-C-O-C)(=C)/p_value/0.9608/effect/deactivating
+- http://localhost:4001/C-C-C-O-C/p_value/0.9784/effect/deactivating
+- http://localhost:4001/C-C-O-C-C/p_value/0.9367/effect/deactivating
+- http://localhost:4001/C-C-C-O-C-C/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C-C(-O-C-C)(-C)(-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(-O-C)(-C)(-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/C=C-C=C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C=C)/p_value/0.9986/effect/deactivating
+- http://localhost:4001/C-C-C=C/p_value/0.9981/effect/deactivating
+- http://localhost:4001/C-C=C-C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C)/p_value/0.9991/effect/deactivating
+- http://localhost:4001/Cl-C-C/p_value/0.7721/effect/deactivating
+- http://localhost:4001/C-C-C-C/p_value/0.9874/effect/deactivating
+- http://localhost:4001/C-C(-C)(-C)/p_value/0.995/effect/deactivating
+http://localhost:4000/InChI=1S/C9H11N3O2/c10-9(13)12(11-14)7-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H2,10,13):
+- http://localhost:4001/N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N=C-O/p_value/0.9495/effect/activating
+- http://localhost:4001/N-C(-O)(=N)/p_value/0.9708/effect/activating
+- http://localhost:4001/N-C-O/p_value/0.9994/effect/activating
+- http://localhost:4001/N-N-C=N/p_value/0.9281/effect/activating
+- http://localhost:4001/C-N(-C=N)(-N)/p_value/0.9708/effect/activating
+- http://localhost:4001/O-C(=N)(-N-N)/p_value/0.9708/effect/activating
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/C=C-C=C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C=C)/p_value/0.9986/effect/deactivating
+- http://localhost:4001/C-C-C=C/p_value/0.9981/effect/deactivating
+- http://localhost:4001/C-C=C-C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C)/p_value/0.9991/effect/deactivating
+- http://localhost:4001/N-N-C/p_value/0.9994/effect/activating
+- http://localhost:4001/C-N(-C)(-N)/p_value/0.9999/effect/activating
+- http://localhost:4001/C-N-C/p_value/0.9961/effect/activating
+- http://localhost:4001/N-N-C-C/p_value/0.9972/effect/activating
+- http://localhost:4001/C-N(-C-C)(-N)/p_value/0.9996/effect/activating
+- http://localhost:4001/N-N-C-C-C/p_value/0.9856/effect/activating
+- http://localhost:4001/C-N(-C-C-C)(-N)/p_value/0.9909/effect/activating
+- http://localhost:4001/C-C-C-C/p_value/0.9874/effect/deactivating
+- http://localhost:4001/N-N/p_value/0.9998/effect/activating
+http://localhost:4000/InChI=1S/C9H11N3O2/c13-10-12-6-2-4-9(12)8-3-1-5-11(14)7-8/h1,3,5,7,9H,2,4,6H2:
+- http://localhost:4001/N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/C-C=C-N=C/p_value/0.9136/effect/deactivating
+- http://localhost:4001/C=C-C=C-N=C/p_value/0.9636/effect/deactivating
+- http://localhost:4001/C-C=N-C=C/p_value/0.9367/effect/deactivating
+- http://localhost:4001/C=C-C=N-C=C/p_value/0.9608/effect/deactivating
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/C=C-C=C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C=C)/p_value/0.9986/effect/deactivating
+- http://localhost:4001/C-C-C=C/p_value/0.9981/effect/deactivating
+- http://localhost:4001/C-C=C-C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C)/p_value/0.9991/effect/deactivating
+- http://localhost:4001/N-N-C/p_value/0.9994/effect/activating
+- http://localhost:4001/C-N(-C)(-N)/p_value/0.9999/effect/activating
+- http://localhost:4001/C-N-C/p_value/0.9961/effect/activating
+- http://localhost:4001/N=C-C/p_value/0.8735/effect/deactivating
+- http://localhost:4001/N-N-C-C/p_value/0.9972/effect/activating
+- http://localhost:4001/C-N(-C-C)(-N)/p_value/0.9996/effect/activating
+- http://localhost:4001/N-N-C-C-C/p_value/0.9856/effect/activating
+- http://localhost:4001/C-N(-C-C-C)(-N)/p_value/0.9909/effect/activating
+- http://localhost:4001/C-C-C-C/p_value/0.9874/effect/deactivating
+- http://localhost:4001/C-C-C-C-C-C/p_value/0.9882/effect/deactivating
+- http://localhost:4001/N-N/p_value/0.9998/effect/activating
+http://localhost:4000/InChI=1S/C14H14ClN3O2S/c1-8-4-3-5-10(9(8)2)16-12-6-11(15)17-14(18-12)21-7-13(19)20/h3-6H,7H2,1-2H3,(H,19,20)(H,16,17,18):
+- http://localhost:4001/O-C=O/p_value/0.9792/effect/deactivating
+- http://localhost:4001/C-C(=O)(-O)/p_value/0.9985/effect/deactivating
+- http://localhost:4001/C-C-S-C/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C=C-N=C/p_value/0.9136/effect/deactivating
+- http://localhost:4001/C=C-C=C-N=C/p_value/0.9636/effect/deactivating
+- http://localhost:4001/S-C=N-C=C/p_value/0.8121/effect/activating
+- http://localhost:4001/C-N-C=N-C=C/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(=N-C=C)(-N)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-N=C-N)(=C)/p_value/0.7022/effect/activating
+- http://localhost:4001/C-C=N-C=C/p_value/0.9367/effect/deactivating
+- http://localhost:4001/C=C-C=N-C=C/p_value/0.9608/effect/deactivating
+- http://localhost:4001/C-C=C-C=C-C-N=C/p_value/0.7696/effect/deactivating
+- http://localhost:4001/N-C=N-C-C=C-C/p_value/0.7022/effect/activating
+- http://localhost:4001/N-C=N-C-C=C/p_value/0.7022/effect/activating
+- http://localhost:4001/S-C=N-C/p_value/0.8121/effect/activating
+- http://localhost:4001/C-C(=N-C)(-N-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(=N-C)(-N)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/S-C=N/p_value/0.8121/effect/activating
+- http://localhost:4001/C-C(=N)(-N)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/C=C-C=C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C=C)/p_value/0.9986/effect/deactivating
+- http://localhost:4001/C-C-C=C/p_value/0.9981/effect/deactivating
+- http://localhost:4001/C-C=C-C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C)/p_value/0.9991/effect/deactivating
+- http://localhost:4001/C-N-C/p_value/0.9961/effect/activating
+- http://localhost:4001/S-C-C/p_value/0.8949/effect/deactivating
+- http://localhost:4001/N=C-C/p_value/0.8735/effect/deactivating
+- http://localhost:4001/C-C-C-C/p_value/0.9874/effect/deactivating
+http://localhost:4000/InChI=1S/C3H7NO2/c1-2-6-3(4)5/h2H2,1H3,(H2,4,5):
+- http://localhost:4001/N=C-O/p_value/0.9495/effect/activating
+- http://localhost:4001/O-C-O/p_value/0.7696/effect/deactivating
+http://localhost:4000/InChI=1S/C3H6ClNO/c1-5(2)3(4)6/h1-2H3:
+- http://localhost:4001/C-N-C/p_value/0.9961/effect/activating
+http://localhost:4000/InChI=1S/C19H24N2O2/c22-18-13-20(19(23)15-7-2-1-3-8-15)12-17-16-9-5-4-6-14(16)10-11-21(17)18/h4-6,9,15,17H,1-3,7-8,10-13H2:
+- http://localhost:4001/O=C-C-N-C=O/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C-C-C-N-C=O/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(=O)(-N-C-C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-N-C=O)(-C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-N-C(=O)(-C))(-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-N-C=O)(-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C-C=O/p_value/0.9998/effect/deactivating
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/C=C-C=C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C=C)/p_value/0.9986/effect/deactivating
+- http://localhost:4001/C-C-C=C/p_value/0.9981/effect/deactivating
+- http://localhost:4001/C-C=C-C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C)/p_value/0.9991/effect/deactivating
+- http://localhost:4001/C-N-C/p_value/0.9961/effect/activating
+- http://localhost:4001/C-C-C-C/p_value/0.9874/effect/deactivating
+- http://localhost:4001/C-C-C-C-C-C/p_value/0.9882/effect/deactivating
+- http://localhost:4001/C-C(-C-C)(-C-C)/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C-C(-C)(-C-C)/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C-C(-C)(-C)/p_value/0.995/effect/deactivating
+http://localhost:4000/InChI=1S/C4H8N2O3/c1-3-9-4(7)6(2)5-8/h3H2,1-2H3:
+- http://localhost:4001/O-C=O/p_value/0.9792/effect/deactivating
+- http://localhost:4001/O=N-N-C=O/p_value/0.8779/effect/activating
+- http://localhost:4001/O-C(=O)(-N-N)/p_value/0.8779/effect/activating
+- http://localhost:4001/C-N(-C=O)(-N)/p_value/0.9223/effect/activating
+- http://localhost:4001/O-C(=O)(-N-C)/p_value/0.8779/effect/activating
+- http://localhost:4001/N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-C-O/p_value/0.9994/effect/activating
+- http://localhost:4001/N-C-O-C/p_value/0.9891/effect/activating
+- http://localhost:4001/N-C-O-C-C/p_value/0.9891/effect/activating
+- http://localhost:4001/N-N-C/p_value/0.9994/effect/activating
+- http://localhost:4001/C-N(-C)(-N)/p_value/0.9999/effect/activating
+- http://localhost:4001/C-N-C/p_value/0.9961/effect/activating
+- http://localhost:4001/N-N/p_value/0.9998/effect/activating
+http://localhost:4000/InChI=1S/C5H13N3O/c1-7(2)4-5-8(3)6-9/h4-5H2,1-3H3:
+- http://localhost:4001/N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-N-C/p_value/0.9994/effect/activating
+- http://localhost:4001/C-N(-C)(-N)/p_value/0.9999/effect/activating
+- http://localhost:4001/C-N-C/p_value/0.9961/effect/activating
+- http://localhost:4001/N-N-C-C/p_value/0.9972/effect/activating
+- http://localhost:4001/C-N(-C-C)(-N)/p_value/0.9996/effect/activating
+- http://localhost:4001/N-N/p_value/0.9998/effect/activating
+http://localhost:4000/InChI=1S/C5H12N2O4/c8-2-1-7(6-11)3-5(10)4-9/h5,8-10H,1-4H2:
+- http://localhost:4001/N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-C-C-O/p_value/0.9669/effect/activating
+- http://localhost:4001/C-N(-C-C-O)(-N)/p_value/0.9726/effect/activating
+- http://localhost:4001/C-C-C-O/p_value/0.9675/effect/deactivating
+- http://localhost:4001/N-N-C/p_value/0.9994/effect/activating
+- http://localhost:4001/C-N(-C)(-N)/p_value/0.9999/effect/activating
+- http://localhost:4001/C-N-C/p_value/0.9961/effect/activating
+- http://localhost:4001/N-N-C-C/p_value/0.9972/effect/activating
+- http://localhost:4001/C-N(-C-C)(-N)/p_value/0.9996/effect/activating
+- http://localhost:4001/N-N-C-C-C/p_value/0.9856/effect/activating
+- http://localhost:4001/C-N(-C-C-C)(-N)/p_value/0.9909/effect/activating
+- http://localhost:4001/N-N/p_value/0.9998/effect/activating
+http://localhost:4000/InChI=1S/C10H13N3O2/c1-13(12-15)7-3-5-10(14)9-4-2-6-11-8-9/h2,4,6,8H,3,5,7H2,1H3:
+- http://localhost:4001/C=C-C=O/p_value/0.9996/effect/deactivating
+- http://localhost:4001/C-C-C=O/p_value/0.9998/effect/deactivating
+- http://localhost:4001/N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/C-C=C-N=C/p_value/0.9136/effect/deactivating
+- http://localhost:4001/C=C-C=C-N=C/p_value/0.9636/effect/deactivating
+- http://localhost:4001/C-C=N-C=C/p_value/0.9367/effect/deactivating
+- http://localhost:4001/C=C-C=N-C=C/p_value/0.9608/effect/deactivating
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/C=C-C=C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C=C)/p_value/0.9986/effect/deactivating
+- http://localhost:4001/C-C-C=C/p_value/0.9981/effect/deactivating
+- http://localhost:4001/C-C=C-C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C)/p_value/0.9991/effect/deactivating
+- http://localhost:4001/N-N-C/p_value/0.9994/effect/activating
+- http://localhost:4001/C-N(-C)(-N)/p_value/0.9999/effect/activating
+- http://localhost:4001/C-N-C/p_value/0.9961/effect/activating
+- http://localhost:4001/N=C-C/p_value/0.8735/effect/deactivating
+- http://localhost:4001/N-N-C-C/p_value/0.9972/effect/activating
+- http://localhost:4001/C-N(-C-C)(-N)/p_value/0.9996/effect/activating
+- http://localhost:4001/N-N-C-C-C/p_value/0.9856/effect/activating
+- http://localhost:4001/C-N(-C-C-C)(-N)/p_value/0.9909/effect/activating
+- http://localhost:4001/C-C-C-C/p_value/0.9874/effect/deactivating
+- http://localhost:4001/C-C-C-C-C-C/p_value/0.9882/effect/deactivating
+- http://localhost:4001/N-N/p_value/0.9998/effect/activating
+http://localhost:4000/InChI=1S/C6H5N2.BF4/c7-8-6-4-2-1-3-5-6;2-1(3,4)5/h1-5H;/q+1;-1:
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/C=C-C=C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C=C-C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/B-F/p_value/0.8949/effect/deactivating
+http://localhost:4000/InChI=1S/C2H3Cl/c1-2-3/h2H,1H2:
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+http://localhost:4000/InChI=1S/C7H6O4/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3,8-9H,(H,10,11):
+- http://localhost:4001/O-C=O/p_value/0.9792/effect/deactivating
+- http://localhost:4001/C-C(=O)(-O)/p_value/0.9985/effect/deactivating
+- http://localhost:4001/C=C-C=O/p_value/0.9996/effect/deactivating
+- http://localhost:4001/C-C-C=O/p_value/0.9998/effect/deactivating
+- http://localhost:4001/O-C=C-O/p_value/0.9417/effect/deactivating
+- http://localhost:4001/O-C-C=C-C=C-O/p_value/0.9685/effect/deactivating
+- http://localhost:4001/O-C(=C-O)(-C=C-C=C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(=C-C=C-O)(-C=C)/p_value/0.983/effect/deactivating
+- http://localhost:4001/O-C(=C-O)(-C=C-C(=C)(-C))/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C-C=C-C=C-O/p_value/0.9286/effect/deactivating
+- http://localhost:4001/C-C(-O)(=C-C=C-C-C-O)/p_value/0.9685/effect/deactivating
+- http://localhost:4001/O-C(=C-O)(-C=C-C-C-O)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(-O)(=C-C=C-C-C)/p_value/0.983/effect/deactivating
+- http://localhost:4001/O-C(=C-O)(-C=C-C-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(-O)(=C-C=C-C)/p_value/0.9908/effect/deactivating
+- http://localhost:4001/O-C(=C-O)(-C=C-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(=C-C=C-O)(-C)/p_value/0.983/effect/deactivating
+- http://localhost:4001/O-C(=C(-O)(-C))(-C=C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/O-C(=C-O)(-C=C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(-O)(=C)/p_value/0.7394/effect/deactivating
+- http://localhost:4001/C-C=C-C-O/p_value/0.9882/effect/deactivating
+- http://localhost:4001/C-C(-C=C-C-O)(=C-C)/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C-C(-C=C-C-O)(=C)/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C-C-C=C-C-O/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C-C(-C-O)(=C)/p_value/0.9882/effect/deactivating
+- http://localhost:4001/C-C-C-O/p_value/0.9675/effect/deactivating
+- http://localhost:4001/C-C=C-C=C-C-C-O/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/C=C-C=C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C=C)/p_value/0.9986/effect/deactivating
+- http://localhost:4001/C-C-C=C/p_value/0.9981/effect/deactivating
+- http://localhost:4001/C-C=C-C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C)/p_value/0.9991/effect/deactivating
+http://localhost:4000/InChI=1S/C6H7N3O/c7-9-6(10)5-1-3-8-4-2-5/h1-4H,7H2,(H,9,10):
+- http://localhost:4001/C=C-C=O/p_value/0.9996/effect/deactivating
+- http://localhost:4001/C-C-C=O/p_value/0.9998/effect/deactivating
+- http://localhost:4001/C-C=C-N=C/p_value/0.9136/effect/deactivating
+- http://localhost:4001/C=C-C=C-N=C/p_value/0.9636/effect/deactivating
+- http://localhost:4001/C-C=N-C=C/p_value/0.9367/effect/deactivating
+- http://localhost:4001/C=C-C=N-C=C/p_value/0.9608/effect/deactivating
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/C=C-C=C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C=C)/p_value/0.9986/effect/deactivating
+- http://localhost:4001/C-C-C=C/p_value/0.9981/effect/deactivating
+- http://localhost:4001/C-C=C-C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C)/p_value/0.9991/effect/deactivating
+- http://localhost:4001/N-N-C/p_value/0.9994/effect/activating
+- http://localhost:4001/N=C-C/p_value/0.8735/effect/deactivating
+- http://localhost:4001/N-N-C-C/p_value/0.9972/effect/activating
+- http://localhost:4001/N-N-C-C-C/p_value/0.9856/effect/activating
+- http://localhost:4001/N-N/p_value/0.9998/effect/activating
+http://localhost:4000/InChI=1S/C6H12N2O4/c1-5(10)2-8(7-12)3-6(11)4-9/h6,9,11H,2-4H2,1H3:
+- http://localhost:4001/N-N-C-C=O/p_value/0.9708/effect/activating
+- http://localhost:4001/C-C(=O)(-C-N-C)/p_value/0.9708/effect/activating
+- http://localhost:4001/C-C(=O)(-C-N)/p_value/0.9822/effect/activating
+- http://localhost:4001/N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-C-C-O/p_value/0.9669/effect/activating
+- http://localhost:4001/C-N(-C-C-O)(-N)/p_value/0.9726/effect/activating
+- http://localhost:4001/C-C-C-O/p_value/0.9675/effect/deactivating
+- http://localhost:4001/N-N-C/p_value/0.9994/effect/activating
+- http://localhost:4001/C-N(-C)(-N)/p_value/0.9999/effect/activating
+- http://localhost:4001/C-N-C/p_value/0.9961/effect/activating
+- http://localhost:4001/N-N-C-C/p_value/0.9972/effect/activating
+- http://localhost:4001/C-N(-C-C)(-N)/p_value/0.9996/effect/activating
+- http://localhost:4001/N-N-C-C-C/p_value/0.9856/effect/activating
+- http://localhost:4001/C-N(-C-C-C)(-N)/p_value/0.9909/effect/activating
+- http://localhost:4001/N-N/p_value/0.9998/effect/activating
+http://localhost:4000/InChI=1S/C16H13N/c1-2-8-15(9-3-1)17-16-11-10-13-6-4-5-7-14(13)12-16/h1-12,17H:
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/C=C-C=C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C=C)/p_value/0.9986/effect/deactivating
+- http://localhost:4001/C-C-C=C/p_value/0.9981/effect/deactivating
+- http://localhost:4001/C-C=C-C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C)/p_value/0.9991/effect/deactivating
+- http://localhost:4001/C-N-C/p_value/0.9961/effect/activating
+- http://localhost:4001/C-C-C-C/p_value/0.9874/effect/deactivating
+http://localhost:4000/InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27?/m0/s1:
+- http://localhost:4001/O-C-C=O/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C=C-C=O/p_value/0.9996/effect/deactivating
+- http://localhost:4001/C-C-C=O/p_value/0.9998/effect/deactivating
+- http://localhost:4001/O-C-O/p_value/0.7696/effect/deactivating
+- http://localhost:4001/C-C(-O-C-O)(-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/O-C=C-O/p_value/0.9417/effect/deactivating
+- http://localhost:4001/O-C-C=C-O/p_value/0.9417/effect/deactivating
+- http://localhost:4001/O-C-C=C-C=C-O/p_value/0.9685/effect/deactivating
+- http://localhost:4001/O-C=C-C=C-C=C-O/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C=C-C=C-C=C-O/p_value/0.8707/effect/deactivating
+- http://localhost:4001/C-C(-O)(=C-C=C-C=C-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C(=C-O)(-C=C-C=C-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C(-C=C-C=C-O)(=C-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C(=C-C=C-C=C-O)(-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C-C=C-C=C-C=C-O/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(-O)(=C-C=C-C=C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C(=C-O)(-C=C-C=C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C(-C=C-O)(=C-C=C-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(-C=C-O)(=C-C=C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(=C-C=C-O)(-C=C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C(-C=C-C=C-O)(=C-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(-O)(=C-C=C-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C(=C-O)(-C=C-C=C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(=C-O)(-C=C-C=C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/O-C(-C=C-O)(=C-C=C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(-C=C-O)(=C-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(=C-C=C-O)(-C=C)/p_value/0.983/effect/deactivating
+- http://localhost:4001/O-C(=C-O)(-C=C-C(=C)(-C))/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C-C=C-C=C-O/p_value/0.9286/effect/deactivating
+- http://localhost:4001/C-C(-O)(=C-C=C-C-C-O)/p_value/0.9685/effect/deactivating
+- http://localhost:4001/O-C(=C-O)(-C=C-C-C-O)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(=C-C=C-O)(-C-C-O)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/O=C(-C=C-C=C-O)(-C-O)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C=C-C-C=C-C=C-O/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(-O)(=C-C=C-C-C)/p_value/0.983/effect/deactivating
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+- http://localhost:4001/C-C(-O)(=C-C=C-C)/p_value/0.9908/effect/deactivating
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+- http://localhost:4001/C-C(=C-O)(-C=C-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/O-C(-C=C-O)(=C-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(-C=C-O)(=C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(=C-C=C-O)(-C)/p_value/0.983/effect/deactivating
+- http://localhost:4001/O-C(=C(-O)(-C))(-C=C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(=C(-O)(-C))(-C=C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(-C=C(-O)(-C))(=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C(=C-O)(-C=C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(=C-O)(-C=C)/p_value/0.9417/effect/deactivating
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+- http://localhost:4001/O-C-C-C=C-O/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C=C-C-C=C-O/p_value/0.8949/effect/deactivating
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+- http://localhost:4001/C-C(-O)(=C-C-C)/p_value/0.9417/effect/deactivating
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+- http://localhost:4001/C-C(=C-O)(-C-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(=C(-O)(-C))(-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(=C-O)(-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(-O)(=C)/p_value/0.7394/effect/deactivating
+- http://localhost:4001/C=C-O-C-C-O/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C-O-C-C-O/p_value/0.9685/effect/deactivating
+- http://localhost:4001/C-O-C-C-O-C/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-O)(-C-O-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-C-O)(-O-C)/p_value/0.9685/effect/deactivating
+- http://localhost:4001/C-C=C-C-O/p_value/0.9882/effect/deactivating
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+- http://localhost:4001/C-C-C=C-C-O/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C-C(-C-O)(=C)/p_value/0.9882/effect/deactivating
+- http://localhost:4001/C-C-C-O/p_value/0.9675/effect/deactivating
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+- http://localhost:4001/C-C-C(-O-C)(=C-C)/p_value/0.8707/effect/deactivating
+- http://localhost:4001/C-C(=C-O-C)(-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C=C-O-C=C/p_value/0.8949/effect/deactivating
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+- http://localhost:4001/C-C-C-C-O-C=C-C/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C=C(-O-C=C-C)(-C-C)/p_value/0.8949/effect/deactivating
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+- http://localhost:4001/C-C-C=C-O-C-C=C-C/p_value/0.8949/effect/deactivating
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+- http://localhost:4001/C=C(-O-C=C-C)(-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-O-C-C=C)(=C-C)/p_value/0.9685/effect/deactivating
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+- http://localhost:4001/C-C-C=C-O-C-C=C-C=C-C/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C(=C-C-O-C=C-C)(-C=C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C=C(-O-C=C-C)(-C=C-C=C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-O-C-C=C-C=C-C)(=C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(=C-O-C-C=C-C=C-C)(-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C(=C-C-O-C=C-C)(-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C=C(-O-C=C-C)(-C(=C-C=C)(-C))/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C=C-C(-C-O-C=C-C)(=C-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C=C(-O-C=C-C)(-C=C-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-O-C-C=C-C=C)(=C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(=C-O-C-C=C-C=C)(-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C-C=C-O-C-C=C-C=C-C=C/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C(=C-C=C-C-O-C=C-C)(-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C=C(-O-C=C-C)(-C=C-C(=C-C=C)(-O))/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-O-C-C=C-C(=C-C=C)(-O))(=C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(=C-O-C-C=C-C(=C-C=C)(-O))(-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C=C(-O-C=C-C)(-C=C-C=C-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-O-C-C=C-C=C-C=C)(=C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(=C-O-C-C=C-C=C-C=C)(-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C(=C-C=C-C-O-C=C)(-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C(=C-C=C-C(-O-C=C)(=C))(-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C=C(-O-C=C)(-C=C-C=C-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C=C(-O-C=C)(-C=C-C=C-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-O-C-C=C-C=C-C=C)(=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C-C=C-C=C-C-O-C=C/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C=C(-O-C=C)(-C=C-C(=C-C)(-O))/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C=C(-O-C=C)(-C=C-C(=C-C)(-O))/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-O-C-C=C-C(=C-C)(-O))(=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C(=C-C-O-C=C)(-C=C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C=C(-O-C=C)(-C=C-C=C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C=C(-O-C=C)(-C=C-C=C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-O-C-C=C-C=C-C)(=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C(=C-C-O-C=C)(-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C=C-C(-C-O-C=C)(=C-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C=C-C(-C(-O-C=C)(=C))(=C-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C(=C-C(-O-C=C)(=C))(-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C=C(-O-C=C)(-C=C-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C=C(-O-C=C)(-C=C-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-O-C-C=C-C=C)(=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C=C(-O-C=C)(-C(=C-C)(-C))/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C=C(-O-C=C)(-C(=C-C)(-C))/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C=C-C(-C-O-C=C)(=C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C=C(-O-C=C)(-C=C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C=C(-O-C=C)(-C=C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-O-C-C=C-C)(=C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(-O-C-C=C)(=C)/p_value/0.9685/effect/deactivating
+- http://localhost:4001/C=C-C-C-O-C=C/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C-C-C-O-C=C/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-O-C-C-C)(=C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(-O-C-C)(=C)/p_value/0.983/effect/deactivating
+- http://localhost:4001/C-C=C-C-O-C/p_value/0.9608/effect/deactivating
+- http://localhost:4001/C-C-C=C-C=C-C-O-C/p_value/0.9685/effect/deactivating
+- http://localhost:4001/C-C-O-C-C=C-C=C/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C=C-C(-C-O-C)(=C-C=C)/p_value/0.9685/effect/deactivating
+- http://localhost:4001/C=C-C(-C-O-C)(=C-C)/p_value/0.9685/effect/deactivating
+- http://localhost:4001/C-C-O-C-C=C/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C-C(-C-O-C)(=C)/p_value/0.9608/effect/deactivating
+- http://localhost:4001/C-C-C-O-C/p_value/0.9784/effect/deactivating
+- http://localhost:4001/C-C-O-C-C/p_value/0.9367/effect/deactivating
+- http://localhost:4001/C-C-C-O-C-C/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/C=C-C=C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C=C)/p_value/0.9986/effect/deactivating
+- http://localhost:4001/C-C-C=C/p_value/0.9981/effect/deactivating
+- http://localhost:4001/C-C=C-C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C)/p_value/0.9991/effect/deactivating
+- http://localhost:4001/C-C-C-C/p_value/0.9874/effect/deactivating
+- http://localhost:4001/C-C-C-C-C-C/p_value/0.9882/effect/deactivating
+http://localhost:4000/InChI=1S/C9H11N3O/c13-11-12-6-2-4-9(12)8-3-1-5-10-7-8/h1,3,5,7,9H,2,4,6H2:
+- http://localhost:4001/N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/C-C=C-N=C/p_value/0.9136/effect/deactivating
+- http://localhost:4001/C=C-C=C-N=C/p_value/0.9636/effect/deactivating
+- http://localhost:4001/C-C=N-C=C/p_value/0.9367/effect/deactivating
+- http://localhost:4001/C=C-C=N-C=C/p_value/0.9608/effect/deactivating
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/C=C-C=C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C=C)/p_value/0.9986/effect/deactivating
+- http://localhost:4001/C-C-C=C/p_value/0.9981/effect/deactivating
+- http://localhost:4001/C-C=C-C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C)/p_value/0.9991/effect/deactivating
+- http://localhost:4001/N-N-C/p_value/0.9994/effect/activating
+- http://localhost:4001/C-N(-C)(-N)/p_value/0.9999/effect/activating
+- http://localhost:4001/C-N-C/p_value/0.9961/effect/activating
+- http://localhost:4001/N=C-C/p_value/0.8735/effect/deactivating
+- http://localhost:4001/N-N-C-C/p_value/0.9972/effect/activating
+- http://localhost:4001/C-N(-C-C)(-N)/p_value/0.9996/effect/activating
+- http://localhost:4001/N-N-C-C-C/p_value/0.9856/effect/activating
+- http://localhost:4001/C-N(-C-C-C)(-N)/p_value/0.9909/effect/activating
+- http://localhost:4001/C-C-C-C/p_value/0.9874/effect/deactivating
+- http://localhost:4001/C-C-C-C-C-C/p_value/0.9882/effect/deactivating
+- http://localhost:4001/N-N/p_value/0.9998/effect/activating
+http://localhost:4000/InChI=1S/C20H22O3/c1-20(2,19(21)22)23-16-12-10-15(11-13-16)18-9-5-7-14-6-3-4-8-17(14)18/h3-4,6,8,10-13,18H,5,7,9H2,1-2H3,(H,21,22):
+- http://localhost:4001/O-C=O/p_value/0.9792/effect/deactivating
+- http://localhost:4001/C-C(=O)(-O)/p_value/0.9985/effect/deactivating
+- http://localhost:4001/O-C-C=O/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C-C-C=O/p_value/0.9998/effect/deactivating
+- http://localhost:4001/C-C(=C-C=C-O)(-C=C)/p_value/0.983/effect/deactivating
+- http://localhost:4001/C-C-C=C-C=C-O/p_value/0.9286/effect/deactivating
+- http://localhost:4001/C=C-C-C=C-C=C-O/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(-O)(=C-C=C-C-C)/p_value/0.983/effect/deactivating
+- http://localhost:4001/C-C(=C-C=C-O)(-C-C)/p_value/0.9685/effect/deactivating
+- http://localhost:4001/C-C(-O)(=C-C=C-C)/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C-C(=C-C=C-O)(-C)/p_value/0.983/effect/deactivating
+- http://localhost:4001/C-C(-O)(=C)/p_value/0.7394/effect/deactivating
+- http://localhost:4001/C=C-O-C-C-O/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C-O-C-C-O/p_value/0.9685/effect/deactivating
+- http://localhost:4001/C-C(-C-O)(-O-C)/p_value/0.9685/effect/deactivating
+- http://localhost:4001/C-C(-O)(-C-O)(-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C=C-C-O/p_value/0.9882/effect/deactivating
+- http://localhost:4001/C-C(-C=C-C-O)(=C-C)/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C-C(-C=C-C-O)(=C)/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C-C-C=C-C-O/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C-C-C-O/p_value/0.9675/effect/deactivating
+- http://localhost:4001/C-C(-C-O)(-C)/p_value/0.983/effect/deactivating
+- http://localhost:4001/C-C(-O)(-C)(-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C=C-C=C-O-C/p_value/0.983/effect/deactivating
+- http://localhost:4001/C-C(-O-C=C-C)(-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-O-C-C)(=C-C)/p_value/0.983/effect/deactivating
+- http://localhost:4001/C-C(-O-C=C)(-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-O-C-C)(=C)/p_value/0.983/effect/deactivating
+- http://localhost:4001/C-C=C-C-O-C/p_value/0.9608/effect/deactivating
+- http://localhost:4001/C-C-O-C-C=C-C=C/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C-C-O-C-C=C/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C-C-O-C-C/p_value/0.9367/effect/deactivating
+- http://localhost:4001/C-C(-O-C-C)(-C)(-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(-O-C)(-C)(-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/C=C-C=C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C=C)/p_value/0.9986/effect/deactivating
+- http://localhost:4001/C-C-C=C/p_value/0.9981/effect/deactivating
+- http://localhost:4001/C-C=C-C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C)/p_value/0.9991/effect/deactivating
+- http://localhost:4001/C-C-C-C/p_value/0.9874/effect/deactivating
+- http://localhost:4001/C-C-C-C-C-C/p_value/0.9882/effect/deactivating
+- http://localhost:4001/C-C(-C-C)(-C-C)/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C-C(-C)(-C-C)/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C-C(-C)(-C)/p_value/0.995/effect/deactivating
+http://localhost:4000/InChI=1S/H4N2.H2O4S/c1-2;1-5(2,3)4/h1-2H2;(H2,1,2,3,4):
+- http://localhost:4001/N-N/p_value/0.9998/effect/activating
+http://localhost:4000/InChI=1S/C20H19N3.ClH/c1-13-12-16(6-11-19(13)23)20(14-2-7-17(21)8-3-14)15-4-9-18(22)10-5-15;/h2-12,21H,22-23H2,1H3;1H:
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/C=C-C=C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C=C)/p_value/0.9986/effect/deactivating
+- http://localhost:4001/C-C-C=C/p_value/0.9981/effect/deactivating
+- http://localhost:4001/C-C=C-C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C)/p_value/0.9991/effect/deactivating
+- http://localhost:4001/N=C-C/p_value/0.8735/effect/deactivating
+- http://localhost:4001/C-C-C-C/p_value/0.9874/effect/deactivating
+http://localhost:4000/InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6):
+- http://localhost:4001/N-C=N-C=N/p_value/0.8949/effect/deactivating
+- http://localhost:4001/N-C(-N=C)(=N)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/N-C-N=C/p_value/0.9417/effect/deactivating
+- http://localhost:4001/N-C-N=C-N/p_value/0.8949/effect/deactivating
+- http://localhost:4001/N-N-C=N-C/p_value/0.8121/effect/activating
+- http://localhost:4001/N-N-C=N/p_value/0.9281/effect/activating
+- http://localhost:4001/N-C(=N)(-N)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/N-N-C/p_value/0.9994/effect/activating
+- http://localhost:4001/N-C-N/p_value/0.9417/effect/deactivating
+- http://localhost:4001/N-N/p_value/0.9998/effect/activating
+http://localhost:4000/InChI=1S/C10H12ClNO2/c1-7(2)14-10(13)12-9-5-3-4-8(11)6-9/h3-7H,1-2H3,(H,12,13):
+- http://localhost:4001/N=C-O/p_value/0.9495/effect/activating
+- http://localhost:4001/O-C-O/p_value/0.7696/effect/deactivating
+- http://localhost:4001/C-C(-O-C-O)(-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-N=C-O-C/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-O-C(=N)(-O))(-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-O-C=N)(-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C=C-N=C/p_value/0.9136/effect/deactivating
+- http://localhost:4001/C=C-C=C-N=C/p_value/0.9636/effect/deactivating
+- http://localhost:4001/C-C=C-C=C-C-N=C/p_value/0.7696/effect/deactivating
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/C=C-C=C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C=C-C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/Cl-C-C/p_value/0.7721/effect/deactivating
+http://localhost:4000/InChI=1S/C12H8Cl6O/c13-8-9(14)11(16)5-3-1-2(6-7(3)19-6)4(5)10(8,15)12(11,17)18/h2-7H,1H2:
+- http://localhost:4001/C-C-C-O/p_value/0.9675/effect/deactivating
+- http://localhost:4001/C-C-C-C-O/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C-C(-C-O)(-C)/p_value/0.983/effect/deactivating
+- http://localhost:4001/C-C-C-O-C/p_value/0.9784/effect/deactivating
+- http://localhost:4001/C-C-O-C-C/p_value/0.9367/effect/deactivating
+- http://localhost:4001/C-C-C-O-C-C/p_value/0.9908/effect/deactivating
+- http://localhost:4001/Cl-C-Cl/p_value/0.7696/effect/deactivating
+- http://localhost:4001/C-C(-Cl)(-Cl)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/C-C-C=C/p_value/0.9981/effect/deactivating
+- http://localhost:4001/C-C=C-C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/Cl-C-C/p_value/0.7721/effect/deactivating
+- http://localhost:4001/Cl-C-C-C/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C-C-C/p_value/0.9874/effect/deactivating
+- http://localhost:4001/C-C-C-C-C-C/p_value/0.9882/effect/deactivating
+- http://localhost:4001/C-C(-C-C)(-C-C)/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C-C(-C)(-C-C)/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C-C(-C)(-C)/p_value/0.995/effect/deactivating
+http://localhost:4000/InChI=1S/C2H8N2O/c3-4-1-2-5/h4-5H,1-3H2:
+- http://localhost:4001/N-C-C-O/p_value/0.9669/effect/activating
+- http://localhost:4001/N-N-C/p_value/0.9994/effect/activating
+- http://localhost:4001/N-N-C-C/p_value/0.9972/effect/activating
+- http://localhost:4001/N-N/p_value/0.9998/effect/activating
+http://localhost:4000/InChI=1S/C6H5NO2/c8-6(9)5-1-3-7-4-2-5/h1-4H,(H,8,9):
+- http://localhost:4001/O-C=O/p_value/0.9792/effect/deactivating
+- http://localhost:4001/C-C(=O)(-O)/p_value/0.9985/effect/deactivating
+- http://localhost:4001/C=C-C=O/p_value/0.9996/effect/deactivating
+- http://localhost:4001/C-C-C=O/p_value/0.9998/effect/deactivating
+- http://localhost:4001/C-C=C-C-O/p_value/0.9882/effect/deactivating
+- http://localhost:4001/C-C(-C-O)(=C)/p_value/0.9882/effect/deactivating
+- http://localhost:4001/C-C-C-O/p_value/0.9675/effect/deactivating
+- http://localhost:4001/C-C=C-N=C/p_value/0.9136/effect/deactivating
+- http://localhost:4001/C=C-C=C-N=C/p_value/0.9636/effect/deactivating
+- http://localhost:4001/C-C=N-C=C/p_value/0.9367/effect/deactivating
+- http://localhost:4001/C=C-C=N-C=C/p_value/0.9608/effect/deactivating
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/C=C-C=C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C=C)/p_value/0.9986/effect/deactivating
+- http://localhost:4001/C-C-C=C/p_value/0.9981/effect/deactivating
+- http://localhost:4001/C-C=C-C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C)/p_value/0.9991/effect/deactivating
+- http://localhost:4001/N=C-C/p_value/0.8735/effect/deactivating
+http://localhost:4000/InChI=1S/C12H12N2O3/c1-2-12(8-6-4-3-5-7-8)9(15)13-11(17)14-10(12)16/h3-7H,2H2,1H3,(H2,13,14,15,16,17):
+- http://localhost:4001/N=C-O/p_value/0.9495/effect/activating
+- http://localhost:4001/C-C-C-O/p_value/0.9675/effect/deactivating
+- http://localhost:4001/C-C=C-C=C-C-C-O/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C-C-C-C-O/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C-C(-C-O)(-C)/p_value/0.983/effect/deactivating
+- http://localhost:4001/N-C-N=C/p_value/0.9417/effect/deactivating
+- http://localhost:4001/N-C-N=C-C/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C-C=N-C/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/C=C-C=C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C=C)/p_value/0.9986/effect/deactivating
+- http://localhost:4001/C-C-C=C/p_value/0.9981/effect/deactivating
+- http://localhost:4001/C-C=C-C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C)/p_value/0.9991/effect/deactivating
+- http://localhost:4001/N-C-N/p_value/0.9417/effect/deactivating
+- http://localhost:4001/N=C-C/p_value/0.8735/effect/deactivating
+- http://localhost:4001/C-C-C-C/p_value/0.9874/effect/deactivating
+- http://localhost:4001/C-C(-C-C)(-C-C)/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C-C(-C)(-C-C)/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C-C(-C)(-C)/p_value/0.995/effect/deactivating
+http://localhost:4000/InChI=1S/C11H8N2O5/c12-11(14)8(9-2-1-5-17-9)6-7-3-4-10(18-7)13(15)16/h1-6H,(H2,12,14):
+- http://localhost:4001/N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N=C-O/p_value/0.9495/effect/activating
+- http://localhost:4001/N-C=C-C=C-O/p_value/0.9522/effect/activating
+- http://localhost:4001/C-C=C-C=C-C=C-O/p_value/0.8707/effect/deactivating
+- http://localhost:4001/N-C(-O)(=C-C=C-C=C)/p_value/0.9522/effect/activating
+- http://localhost:4001/C-C-C=C-C=C-O/p_value/0.9286/effect/deactivating
+- http://localhost:4001/N-C(-O)(=C-C=C-C)/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C(-O)(=C-C=C)/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C(-O)(=C-C)/p_value/0.9708/effect/activating
+- http://localhost:4001/N-C(-O)(=C)/p_value/0.9708/effect/activating
+- http://localhost:4001/C-C(-O)(=C)/p_value/0.7394/effect/deactivating
+- http://localhost:4001/N-C-O/p_value/0.9994/effect/activating
+- http://localhost:4001/C-C=C-C-O/p_value/0.9882/effect/deactivating
+- http://localhost:4001/C-C(-C-O)(=C)/p_value/0.9882/effect/deactivating
+- http://localhost:4001/C-C-C-O/p_value/0.9675/effect/deactivating
+- http://localhost:4001/N-C-O-C=C-C/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C(-O-C)(=C-C)/p_value/0.9522/effect/activating
+- http://localhost:4001/C-C-C(-O-C)(=C-C)/p_value/0.8707/effect/deactivating
+- http://localhost:4001/N-C(-O-C=C)(=C)/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C-O-C=C/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C(-O-C-C)(=C-C)/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C(-O-C-C=C)(=C-C)/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C(-O-C-C=C)(=C)/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C(-O-C-C)(=C)/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C(-O-C)(=C)/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C-O-C/p_value/0.9891/effect/activating
+- http://localhost:4001/C-C=C-C-O-C/p_value/0.9608/effect/deactivating
+- http://localhost:4001/N-C-O-C-C=C/p_value/0.9522/effect/activating
+- http://localhost:4001/C-C(-C-O-C)(=C)/p_value/0.9608/effect/deactivating
+- http://localhost:4001/C-C-C-O-C/p_value/0.9784/effect/deactivating
+- http://localhost:4001/N-C-O-C-C/p_value/0.9891/effect/activating
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/C=C-C=C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C=C)/p_value/0.9986/effect/deactivating
+- http://localhost:4001/C-C-C=C/p_value/0.9981/effect/deactivating
+- http://localhost:4001/C-C=C-C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C)/p_value/0.9991/effect/deactivating
+- http://localhost:4001/N=C-C/p_value/0.8735/effect/deactivating
+http://localhost:4000/InChI=1S/C9H7N3O4S/c1-5(13)10-9-11-6(4-17-9)7-2-3-8(16-7)12(14)15/h2-4H,1H3,(H,10,11,13):
+- http://localhost:4001/N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N=C-O/p_value/0.9495/effect/activating
+- http://localhost:4001/N-C=C-C=C-O/p_value/0.9522/effect/activating
+- http://localhost:4001/S-C=C-C=C-C=C-O/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-O)(=C-C=C-C=C)/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C(-C=C-C=C-O)(=C)/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C-C=C-C=C-O/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-O)(=C-C=C-C)/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C(-O)(=C-C=C)/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C(-O)(=C-C)/p_value/0.9708/effect/activating
+- http://localhost:4001/N-C(-O)(=C)/p_value/0.9708/effect/activating
+- http://localhost:4001/C-C(-O)(=C)/p_value/0.7394/effect/deactivating
+- http://localhost:4001/N-C-O/p_value/0.9994/effect/activating
+- http://localhost:4001/S-C=C-C-O/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-C(-O)(=C))(=C)/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-C-O)(=C)/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C-C-O/p_value/0.9669/effect/activating
+- http://localhost:4001/N-C-O-C=C-C/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C(-O-C)(=C-C)/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C-C(-O-C)(=C-C)/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-C(-O-C)(=C-C))(=C)/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-O-C=C)(=C)/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C-O-C=C/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C-C-O-C=C-C/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-O-C-C)(=C-C)/p_value/0.9522/effect/activating
+- http://localhost:4001/S-C=C-C-O-C=C-C/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-C-O-C=C-C)(=C)/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-O-C-C=C)(=C-C)/p_value/0.9522/effect/activating
+- http://localhost:4001/S-C=C-C-O-C=C/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-C-O-C=C)(=C)/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-O-C-C=C)(=C)/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C-C-O-C=C/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-O-C-C)(=C)/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C(-O-C)(=C)/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C-O-C/p_value/0.9891/effect/activating
+- http://localhost:4001/S-C=C-C-O-C/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C-O-C-C=C/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C(-C-O-C)(=C)/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C-C-O-C/p_value/0.9891/effect/activating
+- http://localhost:4001/N-C-O-C-C/p_value/0.9891/effect/activating
+- http://localhost:4001/C-C-N=C-S-C/p_value/0.9223/effect/activating
+- http://localhost:4001/C=N-C(-S-C)(=N-C)/p_value/0.8779/effect/activating
+- http://localhost:4001/N-C=C-S-C/p_value/0.9223/effect/activating
+- http://localhost:4001/C=C-C=C-S-C/p_value/0.9223/effect/activating
+- http://localhost:4001/N=C-S-C=C-C/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C-S-C=C-C/p_value/0.9223/effect/activating
+- http://localhost:4001/N=C-S-C=C/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C-S-C=C/p_value/0.9223/effect/activating
+- http://localhost:4001/C=N-C-S-C/p_value/0.8779/effect/activating
+- http://localhost:4001/S-C-N=C/p_value/0.9223/effect/activating
+- http://localhost:4001/C=C-N=C-N=C/p_value/0.9223/effect/activating
+- http://localhost:4001/C-C-N=C-N=C/p_value/0.8779/effect/activating
+- http://localhost:4001/S-C(-N=C-C)(=N-C)/p_value/0.8779/effect/activating
+- http://localhost:4001/S-C(-N=C)(=N-C)/p_value/0.9223/effect/activating
+- http://localhost:4001/S-C=C-N=C/p_value/0.9223/effect/activating
+- http://localhost:4001/S-C=N-C=C/p_value/0.8121/effect/activating
+- http://localhost:4001/C-C(-N=C(-S)(-N))(=C)/p_value/0.9223/effect/activating
+- http://localhost:4001/C-C(-N=C-S)(=C)/p_value/0.9223/effect/activating
+- http://localhost:4001/S-C=C-N=C-N/p_value/0.9223/effect/activating
+- http://localhost:4001/C-C(-N=C-N)(=C)/p_value/0.7022/effect/activating
+- http://localhost:4001/N-C=C-C=C-C-N=C/p_value/0.9223/effect/activating
+- http://localhost:4001/S-C=N-C-C=C-C=C/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C=C-C=C-C-N=C-N/p_value/0.9223/effect/activating
+- http://localhost:4001/S-C=C(-N=C-N)(-C=C-C=C)/p_value/0.9223/effect/activating
+- http://localhost:4001/O-C(-C-N=C-N)(=C-C=C)/p_value/0.9223/effect/activating
+- http://localhost:4001/O-C(-C(-N=C)(=C))(=C-C=C)/p_value/0.9223/effect/activating
+- http://localhost:4001/O-C(-C-N=C)(=C-C=C)/p_value/0.9223/effect/activating
+- http://localhost:4001/S-C=N-C-C=C-C/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C=N-C-C=C-C/p_value/0.7022/effect/activating
+- http://localhost:4001/S-C=C(-N=C-N)(-C=C-C)/p_value/0.9223/effect/activating
+- http://localhost:4001/O-C(-C-N=C-N)(=C-C)/p_value/0.9223/effect/activating
+- http://localhost:4001/O-C(-C-N=C)(=C-C)/p_value/0.9223/effect/activating
+- http://localhost:4001/S-C=N-C-C=C/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C=N-C-C=C/p_value/0.7022/effect/activating
+- http://localhost:4001/S-C=N-C-C/p_value/0.9223/effect/activating
+- http://localhost:4001/S-C=N-C/p_value/0.8121/effect/activating
+- http://localhost:4001/S-C-N=C-C/p_value/0.8779/effect/activating
+- http://localhost:4001/S-C=N/p_value/0.8121/effect/activating
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/C=C-C=C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C=C-C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/N=C-C/p_value/0.8735/effect/deactivating
+http://localhost:4000/InChI=1S/C8H6N4O4S/c13-4-9-11-8-10-5(3-17-8)6-1-2-7(16-6)12(14)15/h1-4H,(H,9,13)(H,10,11):
+- http://localhost:4001/N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N=C-O/p_value/0.9495/effect/activating
+- http://localhost:4001/N-C=C-C=C-O/p_value/0.9522/effect/activating
+- http://localhost:4001/S-C=C-C=C-C=C-O/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-O)(=C-C=C-C=C)/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C(-C=C-C=C-O)(=C)/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C-C=C-C=C-O/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-O)(=C-C=C-C)/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C(-O)(=C-C=C)/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C(-O)(=C-C)/p_value/0.9708/effect/activating
+- http://localhost:4001/N-C(-O)(=C)/p_value/0.9708/effect/activating
+- http://localhost:4001/C-C(-O)(=C)/p_value/0.7394/effect/deactivating
+- http://localhost:4001/N-C-O/p_value/0.9994/effect/activating
+- http://localhost:4001/S-C=C-C-O/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-C(-O)(=C))(=C)/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-C-O)(=C)/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C-C-O/p_value/0.9669/effect/activating
+- http://localhost:4001/N-C-O-C=C-C/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C(-O-C)(=C-C)/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C-C(-O-C)(=C-C)/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-C(-O-C)(=C-C))(=C)/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-O-C=C)(=C)/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C-O-C=C/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C-C-O-C=C-C/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-O-C-C)(=C-C)/p_value/0.9522/effect/activating
+- http://localhost:4001/S-C=C-C-O-C=C-C/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-C-O-C=C-C)(=C)/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-O-C-C=C)(=C-C)/p_value/0.9522/effect/activating
+- http://localhost:4001/S-C=C-C-O-C=C/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-C-O-C=C)(=C)/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-O-C-C=C)(=C)/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C-C-O-C=C/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-O-C-C)(=C)/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C(-O-C)(=C)/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C-O-C/p_value/0.9891/effect/activating
+- http://localhost:4001/S-C=C-C-O-C/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C-O-C-C=C/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C(-C-O-C)(=C)/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C-C-O-C/p_value/0.9891/effect/activating
+- http://localhost:4001/N-C-O-C-C/p_value/0.9891/effect/activating
+- http://localhost:4001/C-C-N=C-S-C/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C=C-S-C/p_value/0.9223/effect/activating
+- http://localhost:4001/C=C-C=C-S-C/p_value/0.9223/effect/activating
+- http://localhost:4001/N=C-S-C=C-C/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C-S-C=C-C/p_value/0.9223/effect/activating
+- http://localhost:4001/N=C-S-C=C/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C-S-C=C/p_value/0.9223/effect/activating
+- http://localhost:4001/S-C=C-N=C/p_value/0.9223/effect/activating
+- http://localhost:4001/S-C=N-C=C/p_value/0.8121/effect/activating
+- http://localhost:4001/C-C(-N=C(-S)(-N))(=C)/p_value/0.9223/effect/activating
+- http://localhost:4001/C-C(-N=C-S)(=C)/p_value/0.9223/effect/activating
+- http://localhost:4001/S-C=C-N=C-N/p_value/0.9223/effect/activating
+- http://localhost:4001/C-C(-N=C-N)(=C)/p_value/0.7022/effect/activating
+- http://localhost:4001/N-C=C-C=C-C-N=C/p_value/0.9223/effect/activating
+- http://localhost:4001/S-C=N-C-C=C-C=C/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C=C-C=C-C-N=C-N/p_value/0.9223/effect/activating
+- http://localhost:4001/S-C=C(-N=C-N)(-C=C-C=C)/p_value/0.9223/effect/activating
+- http://localhost:4001/O-C(-C-N=C-N)(=C-C=C)/p_value/0.9223/effect/activating
+- http://localhost:4001/O-C(-C(-N=C)(=C))(=C-C=C)/p_value/0.9223/effect/activating
+- http://localhost:4001/O-C(-C-N=C)(=C-C=C)/p_value/0.9223/effect/activating
+- http://localhost:4001/S-C=N-C-C=C-C/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C=N-C-C=C-C/p_value/0.7022/effect/activating
+- http://localhost:4001/S-C=C(-N=C-N)(-C=C-C)/p_value/0.9223/effect/activating
+- http://localhost:4001/O-C(-C-N=C-N)(=C-C)/p_value/0.9223/effect/activating
+- http://localhost:4001/O-C(-C-N=C)(=C-C)/p_value/0.9223/effect/activating
+- http://localhost:4001/S-C=N-C-C=C/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C=N-C-C=C/p_value/0.7022/effect/activating
+- http://localhost:4001/S-C=N-C-C/p_value/0.9223/effect/activating
+- http://localhost:4001/N-N-C=N-C-C/p_value/0.9522/effect/activating
+- http://localhost:4001/S-C=N-C/p_value/0.8121/effect/activating
+- http://localhost:4001/N-N-C=N-C/p_value/0.8121/effect/activating
+- http://localhost:4001/S-C=N/p_value/0.8121/effect/activating
+- http://localhost:4001/N-N-C=N/p_value/0.9281/effect/activating
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/C=C-C=C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C=C-C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/N-N-C/p_value/0.9994/effect/activating
+- http://localhost:4001/N-N/p_value/0.9998/effect/activating
+http://localhost:4000/InChI=1S/C4H7N3O3/c1-3(8)2-7(6-10)4(5)9/h2H2,1H3,(H2,5,9):
+- http://localhost:4001/N-N-C-C=O/p_value/0.9708/effect/activating
+- http://localhost:4001/C-C(=O)(-C-N-C)/p_value/0.9708/effect/activating
+- http://localhost:4001/C-C(=O)(-C-N)/p_value/0.9822/effect/activating
+- http://localhost:4001/N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N=C-O/p_value/0.9495/effect/activating
+- http://localhost:4001/N-C(-O)(=N)/p_value/0.9708/effect/activating
+- http://localhost:4001/N-C-O/p_value/0.9994/effect/activating
+- http://localhost:4001/N-N-C=N/p_value/0.9281/effect/activating
+- http://localhost:4001/C-N(-C=N)(-N)/p_value/0.9708/effect/activating
+- http://localhost:4001/O-C(=N)(-N-N)/p_value/0.9708/effect/activating
+- http://localhost:4001/N-N-C/p_value/0.9994/effect/activating
+- http://localhost:4001/C-N(-C)(-N)/p_value/0.9999/effect/activating
+- http://localhost:4001/C-N-C/p_value/0.9961/effect/activating
+- http://localhost:4001/N-N-C-C/p_value/0.9972/effect/activating
+- http://localhost:4001/C-N(-C-C)(-N)/p_value/0.9996/effect/activating
+- http://localhost:4001/N-N-C-C-C/p_value/0.9856/effect/activating
+- http://localhost:4001/C-N(-C-C-C)(-N)/p_value/0.9909/effect/activating
+- http://localhost:4001/N-N/p_value/0.9998/effect/activating
+http://localhost:4000/InChI=1S/C15H13NO/c1-10(17)16-13-6-7-15-12(9-13)8-11-4-2-3-5-14(11)15/h2-7,9H,8H2,1H3,(H,16,17):
+- http://localhost:4001/N=C-O/p_value/0.9495/effect/activating
+- http://localhost:4001/C-C=C-N=C/p_value/0.9136/effect/deactivating
+- http://localhost:4001/C=C-C=C-N=C/p_value/0.9636/effect/deactivating
+- http://localhost:4001/C-C=N-C=C/p_value/0.9367/effect/deactivating
+- http://localhost:4001/C-C=C-C=C-C-N=C/p_value/0.7696/effect/deactivating
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/C=C-C=C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C=C)/p_value/0.9986/effect/deactivating
+- http://localhost:4001/C-C-C=C/p_value/0.9981/effect/deactivating
+- http://localhost:4001/C-C=C-C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C)/p_value/0.9991/effect/deactivating
+- http://localhost:4001/N=C-C/p_value/0.8735/effect/deactivating
+- http://localhost:4001/C-C-C-C/p_value/0.9874/effect/deactivating
+http://localhost:4000/InChI=1S/C4H6N2O3/c1-3-2-6(5-8)4(7)9-3/h3H,2H2,1H3:
+- http://localhost:4001/O-C=O/p_value/0.9792/effect/deactivating
+- http://localhost:4001/O=N-N-C=O/p_value/0.8779/effect/activating
+- http://localhost:4001/O-C(=O)(-N-N)/p_value/0.8779/effect/activating
+- http://localhost:4001/C-N(-C=O)(-N)/p_value/0.9223/effect/activating
+- http://localhost:4001/O-C(=O)(-N-C)/p_value/0.8779/effect/activating
+- http://localhost:4001/N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-C-O/p_value/0.9994/effect/activating
+- http://localhost:4001/N-C-C-O/p_value/0.9669/effect/activating
+- http://localhost:4001/C-N(-C-C-O)(-N)/p_value/0.9726/effect/activating
+- http://localhost:4001/N-C-O-C/p_value/0.9891/effect/activating
+- http://localhost:4001/N-C-C-O-C/p_value/0.9891/effect/activating
+- http://localhost:4001/N-C-O-C-C/p_value/0.9891/effect/activating
+- http://localhost:4001/N-N-C/p_value/0.9994/effect/activating
+- http://localhost:4001/C-N(-C)(-N)/p_value/0.9999/effect/activating
+- http://localhost:4001/C-N-C/p_value/0.9961/effect/activating
+- http://localhost:4001/N-N-C-C/p_value/0.9972/effect/activating
+- http://localhost:4001/C-N(-C-C)(-N)/p_value/0.9996/effect/activating
+- http://localhost:4001/N-N-C-C-C/p_value/0.9856/effect/activating
+- http://localhost:4001/C-N(-C-C-C)(-N)/p_value/0.9909/effect/activating
+- http://localhost:4001/N-N/p_value/0.9998/effect/activating
+http://localhost:4000/InChI=1S/C5H4O2/c6-4-5-2-1-3-7-5/h1-4H:
+- http://localhost:4001/O-C-C=O/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C=C-C=O/p_value/0.9996/effect/deactivating
+- http://localhost:4001/C-C(-O)(=C)/p_value/0.7394/effect/deactivating
+- http://localhost:4001/O=C-C(-O-C)(=C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/C=C-C=C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C=C-C/p_value/0.9984/effect/deactivating
+http://localhost:4000/InChI=1S/C5H10N2O3/c1-5(9)4-7(6-10)2-3-8/h8H,2-4H2,1H3:
+- http://localhost:4001/N-N-C-C=O/p_value/0.9708/effect/activating
+- http://localhost:4001/C-C(=O)(-C-N-C)/p_value/0.9708/effect/activating
+- http://localhost:4001/C-C(=O)(-C-N)/p_value/0.9822/effect/activating
+- http://localhost:4001/N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-C-C-O/p_value/0.9669/effect/activating
+- http://localhost:4001/C-N(-C-C-O)(-N)/p_value/0.9726/effect/activating
+- http://localhost:4001/N-N-C/p_value/0.9994/effect/activating
+- http://localhost:4001/C-N(-C)(-N)/p_value/0.9999/effect/activating
+- http://localhost:4001/C-N-C/p_value/0.9961/effect/activating
+- http://localhost:4001/N-N-C-C/p_value/0.9972/effect/activating
+- http://localhost:4001/C-N(-C-C)(-N)/p_value/0.9996/effect/activating
+- http://localhost:4001/N-N-C-C-C/p_value/0.9856/effect/activating
+- http://localhost:4001/C-N(-C-C-C)(-N)/p_value/0.9909/effect/activating
+- http://localhost:4001/N-N/p_value/0.9998/effect/activating
+http://localhost:4000/InChI=1S/CH6N2/c1-3-2/h3H,2H2,1H3:
+- http://localhost:4001/N-N-C/p_value/0.9994/effect/activating
+- http://localhost:4001/N-N/p_value/0.9998/effect/activating
+http://localhost:4000/InChI=1S/C4H5Cl/c1-3-4(2)5/h3H,1-2H2:
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/C=C-C=C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/Cl-C-C/p_value/0.7721/effect/deactivating
+http://localhost:4000/InChI=1S/C6H11N3O3/c1-3-9(8-12)6(11)7-4-5(2)10/h3-4H2,1-2H3,(H,7,11):
+- http://localhost:4001/C-C(=O)(-C-N)/p_value/0.9822/effect/activating
+- http://localhost:4001/N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N=C-O/p_value/0.9495/effect/activating
+- http://localhost:4001/N-C(-O)(=N)/p_value/0.9708/effect/activating
+- http://localhost:4001/N-C-O/p_value/0.9994/effect/activating
+- http://localhost:4001/N-N-C=N-C-C/p_value/0.9522/effect/activating
+- http://localhost:4001/N-N-C=N-C/p_value/0.8121/effect/activating
+- http://localhost:4001/C-N(-C=N-C)(-N)/p_value/0.9223/effect/activating
+- http://localhost:4001/O-C(=N-C)(-N-N)/p_value/0.9223/effect/activating
+- http://localhost:4001/C-C-N-C=N-C-C/p_value/0.9223/effect/activating
+- http://localhost:4001/O-C(=N-C-C)(-N-C)/p_value/0.9223/effect/activating
+- http://localhost:4001/N-N(-C=N-C)(-C-C)/p_value/0.9223/effect/activating
+- http://localhost:4001/O-C(=N-C)(-N-C-C)/p_value/0.9223/effect/activating
+- http://localhost:4001/O-C(=N-C)(-N-C)/p_value/0.9223/effect/activating
+- http://localhost:4001/N-N-C=N/p_value/0.9281/effect/activating
+- http://localhost:4001/C-N(-C=N)(-N)/p_value/0.9708/effect/activating
+- http://localhost:4001/O-C(=N)(-N-N)/p_value/0.9708/effect/activating
+- http://localhost:4001/N-N-C/p_value/0.9994/effect/activating
+- http://localhost:4001/C-N(-C)(-N)/p_value/0.9999/effect/activating
+- http://localhost:4001/C-N-C/p_value/0.9961/effect/activating
+- http://localhost:4001/N-N-C-C/p_value/0.9972/effect/activating
+- http://localhost:4001/C-N(-C-C)(-N)/p_value/0.9996/effect/activating
+- http://localhost:4001/N-N/p_value/0.9998/effect/activating
+http://localhost:4000/InChI=1S/C5H6N2OS/c1-3-2-4(8)7-5(9)6-3/h2H,1H3,(H2,6,7,8,9):
+- http://localhost:4001/N-C(-O)(=C-C)/p_value/0.9708/effect/activating
+- http://localhost:4001/N-C(-O)(=C)/p_value/0.9708/effect/activating
+- http://localhost:4001/N-C-O/p_value/0.9994/effect/activating
+- http://localhost:4001/S-C-N=C/p_value/0.9223/effect/activating
+- http://localhost:4001/C=C-N=C-N=C/p_value/0.9223/effect/activating
+- http://localhost:4001/S-C(-N=C-C)(=N-C)/p_value/0.8779/effect/activating
+- http://localhost:4001/S-C(-N=C)(=N-C)/p_value/0.9223/effect/activating
+- http://localhost:4001/C-C=C-N=C/p_value/0.9136/effect/deactivating
+- http://localhost:4001/S-C=N-C=C/p_value/0.8121/effect/activating
+- http://localhost:4001/S-C=N-C/p_value/0.8121/effect/activating
+- http://localhost:4001/S-C-N=C-C/p_value/0.8779/effect/activating
+- http://localhost:4001/S-C=N/p_value/0.8121/effect/activating
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/C-C-C=C/p_value/0.9981/effect/deactivating
+- http://localhost:4001/N=C-C/p_value/0.8735/effect/deactivating
+http://localhost:4000/InChI=1S/C2HCl3/c3-1-2(4)5/h1H:
+- http://localhost:4001/Cl-C-Cl/p_value/0.7696/effect/deactivating
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+http://localhost:4000/InChI=1S/C2H8N2/c1-4(2)3/h3H2,1-2H3:
+- http://localhost:4001/N-N-C/p_value/0.9994/effect/activating
+- http://localhost:4001/C-N(-C)(-N)/p_value/0.9999/effect/activating
+- http://localhost:4001/C-N-C/p_value/0.9961/effect/activating
+- http://localhost:4001/N-N/p_value/0.9998/effect/activating
+http://localhost:4000/InChI=1S/C2H8N2.2ClH/c1-3-4-2;;/h3-4H,1-2H3;2*1H:
+- http://localhost:4001/N-N-C/p_value/0.9994/effect/activating
+- http://localhost:4001/N-N/p_value/0.9998/effect/activating
+http://localhost:4000/InChI=1S/C14H8Cl4/c15-11-5-1-9(2-6-11)13(14(17)18)10-3-7-12(16)8-4-10/h1-8H:
+- http://localhost:4001/Cl-C-Cl/p_value/0.7696/effect/deactivating
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/C=C-C=C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C=C)/p_value/0.9986/effect/deactivating
+- http://localhost:4001/C-C-C=C/p_value/0.9981/effect/deactivating
+- http://localhost:4001/C-C=C-C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C)/p_value/0.9991/effect/deactivating
+- http://localhost:4001/Cl-C-C/p_value/0.7721/effect/deactivating
+- http://localhost:4001/C-C-C-C/p_value/0.9874/effect/deactivating
+http://localhost:4000/InChI=1S/C3H6N2O/c6-4-5-2-1-3-5/h1-3H2:
+- http://localhost:4001/N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-N-C/p_value/0.9994/effect/activating
+- http://localhost:4001/C-N(-C)(-N)/p_value/0.9999/effect/activating
+- http://localhost:4001/C-N-C/p_value/0.9961/effect/activating
+- http://localhost:4001/N-N-C-C/p_value/0.9972/effect/activating
+- http://localhost:4001/C-N(-C-C)(-N)/p_value/0.9996/effect/activating
+- http://localhost:4001/N-N-C-C-C/p_value/0.9856/effect/activating
+- http://localhost:4001/N-N/p_value/0.9998/effect/activating
+http://localhost:4000/InChI=1S/C5H11N3O3/c1-2-8(7-11)5(10)6-3-4-9/h9H,2-4H2,1H3,(H,6,10):
+- http://localhost:4001/N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N=C-O/p_value/0.9495/effect/activating
+- http://localhost:4001/N-C(-O)(=N)/p_value/0.9708/effect/activating
+- http://localhost:4001/N-C-O/p_value/0.9994/effect/activating
+- http://localhost:4001/N-C-C-O/p_value/0.9669/effect/activating
+- http://localhost:4001/N-N-C=N-C-C/p_value/0.9522/effect/activating
+- http://localhost:4001/N-N-C=N-C/p_value/0.8121/effect/activating
+- http://localhost:4001/C-N(-C=N-C)(-N)/p_value/0.9223/effect/activating
+- http://localhost:4001/O-C(=N-C)(-N-N)/p_value/0.9223/effect/activating
+- http://localhost:4001/C-C-N-C=N-C-C/p_value/0.9223/effect/activating
+- http://localhost:4001/O-C(=N-C-C)(-N-C)/p_value/0.9223/effect/activating
+- http://localhost:4001/N-N(-C=N-C)(-C-C)/p_value/0.9223/effect/activating
+- http://localhost:4001/O-C(=N-C)(-N-C-C)/p_value/0.9223/effect/activating
+- http://localhost:4001/O-C(=N-C)(-N-C)/p_value/0.9223/effect/activating
+- http://localhost:4001/N-N-C=N/p_value/0.9281/effect/activating
+- http://localhost:4001/C-N(-C=N)(-N)/p_value/0.9708/effect/activating
+- http://localhost:4001/O-C(=N)(-N-N)/p_value/0.9708/effect/activating
+- http://localhost:4001/N-N-C/p_value/0.9994/effect/activating
+- http://localhost:4001/C-N(-C)(-N)/p_value/0.9999/effect/activating
+- http://localhost:4001/C-N-C/p_value/0.9961/effect/activating
+- http://localhost:4001/N-N-C-C/p_value/0.9972/effect/activating
+- http://localhost:4001/C-N(-C-C)(-N)/p_value/0.9996/effect/activating
+- http://localhost:4001/N-N/p_value/0.9998/effect/activating
+http://localhost:4000/InChI=1S/HNO2.Na/c2-1-3;/h(H,2,3);/q;+1/p-1:
+- http://localhost:4001/N=O/p_value/0.9997/effect/activating
+http://localhost:4000/InChI=1S/C8H5N3O4S/c12-4-9-8-10-5(3-16-8)6-1-2-7(15-6)11(13)14/h1-4H,(H,9,10,12):
+- http://localhost:4001/N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N=C-O/p_value/0.9495/effect/activating
+- http://localhost:4001/N-C=C-C=C-O/p_value/0.9522/effect/activating
+- http://localhost:4001/S-C=C-C=C-C=C-O/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-O)(=C-C=C-C=C)/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C(-C=C-C=C-O)(=C)/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C-C=C-C=C-O/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-O)(=C-C=C-C)/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C(-O)(=C-C=C)/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C(-O)(=C-C)/p_value/0.9708/effect/activating
+- http://localhost:4001/N-C(-O)(=C)/p_value/0.9708/effect/activating
+- http://localhost:4001/C-C(-O)(=C)/p_value/0.7394/effect/deactivating
+- http://localhost:4001/N-C-O/p_value/0.9994/effect/activating
+- http://localhost:4001/S-C=C-C-O/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-C(-O)(=C))(=C)/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-C-O)(=C)/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C-C-O/p_value/0.9669/effect/activating
+- http://localhost:4001/N-C-O-C=C-C/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C(-O-C)(=C-C)/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C-C(-O-C)(=C-C)/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-C(-O-C)(=C-C))(=C)/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-O-C=C)(=C)/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C-O-C=C/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C-C-O-C=C-C/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-O-C-C)(=C-C)/p_value/0.9522/effect/activating
+- http://localhost:4001/S-C=C-C-O-C=C-C/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-C-O-C=C-C)(=C)/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-O-C-C=C)(=C-C)/p_value/0.9522/effect/activating
+- http://localhost:4001/S-C=C-C-O-C=C/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-C-O-C=C)(=C)/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-O-C-C=C)(=C)/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C-C-O-C=C/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C(-O-C-C)(=C)/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C(-O-C)(=C)/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C-O-C/p_value/0.9891/effect/activating
+- http://localhost:4001/S-C=C-C-O-C/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C-O-C-C=C/p_value/0.9522/effect/activating
+- http://localhost:4001/N-C(-C-O-C)(=C)/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C-C-O-C/p_value/0.9891/effect/activating
+- http://localhost:4001/N-C-O-C-C/p_value/0.9891/effect/activating
+- http://localhost:4001/C-C-N=C-S-C/p_value/0.9223/effect/activating
+- http://localhost:4001/C=N-C(-S-C)(=N-C)/p_value/0.8779/effect/activating
+- http://localhost:4001/N-C=C-S-C/p_value/0.9223/effect/activating
+- http://localhost:4001/C=C-C=C-S-C/p_value/0.9223/effect/activating
+- http://localhost:4001/N=C-S-C=C-C/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C-S-C=C-C/p_value/0.9223/effect/activating
+- http://localhost:4001/N=C-S-C=C/p_value/0.9223/effect/activating
+- http://localhost:4001/N-C-S-C=C/p_value/0.9223/effect/activating
+- http://localhost:4001/C=N-C-S-C/p_value/0.8779/effect/activating
+- http://localhost:4001/S-C-N=C/p_value/0.9223/effect/activating
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+- http://localhost:4001/C-N(-C-C-C)(-N)/p_value/0.9909/effect/activating
+- http://localhost:4001/N-N/p_value/0.9998/effect/activating
+http://localhost:4000/InChI=1S/C14H19N3S.ClH/c1-16(2)9-10-17(12-13-6-5-11-18-13)14-7-3-4-8-15-14;/h3-8,11H,9-10,12H2,1-2H3;1H:
+- http://localhost:4001/C-C-S-C/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C=C-N=C/p_value/0.9136/effect/deactivating
+- http://localhost:4001/C=C-C=C-N=C/p_value/0.9636/effect/deactivating
+- http://localhost:4001/C-N-C=N-C=C/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(=N-C=C)(-N)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C=N-C=C/p_value/0.9367/effect/deactivating
+- http://localhost:4001/C=C-C=N-C=C/p_value/0.9608/effect/deactivating
+- http://localhost:4001/C-C(=N-C)(-N-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(=N-C)(-N)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(=N)(-N)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/C=C-C=C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C=C-C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-N-C/p_value/0.9961/effect/activating
+- http://localhost:4001/S-C-C/p_value/0.8949/effect/deactivating
+- http://localhost:4001/N=C-C/p_value/0.8735/effect/deactivating
+http://localhost:4000/InChI=1S/C6H12N4O2/c1-5-3-9(7-11)4-6(2)10(5)8-12/h5-6H,3-4H2,1-2H3:
+- http://localhost:4001/N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-N-C/p_value/0.9994/effect/activating
+- http://localhost:4001/C-N(-C)(-N)/p_value/0.9999/effect/activating
+- http://localhost:4001/C-N-C/p_value/0.9961/effect/activating
+- http://localhost:4001/N-N-C-C/p_value/0.9972/effect/activating
+- http://localhost:4001/C-N(-C-C)(-N)/p_value/0.9996/effect/activating
+- http://localhost:4001/N-N-C-C-C/p_value/0.9856/effect/activating
+- http://localhost:4001/C-N(-C-C-C)(-N)/p_value/0.9909/effect/activating
+- http://localhost:4001/N-N/p_value/0.9998/effect/activating
+http://localhost:4000/InChI=1S/C4H8N2O2/c7-5-6-1-3-8-4-2-6/h1-4H2:
+- http://localhost:4001/N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-C-C-O/p_value/0.9669/effect/activating
+- http://localhost:4001/C-N(-C-C-O)(-N)/p_value/0.9726/effect/activating
+- http://localhost:4001/N-C-C-O-C/p_value/0.9891/effect/activating
+- http://localhost:4001/C-C-O-C-C/p_value/0.9367/effect/deactivating
+- http://localhost:4001/N-N-C/p_value/0.9994/effect/activating
+- http://localhost:4001/C-N(-C)(-N)/p_value/0.9999/effect/activating
+- http://localhost:4001/C-N-C/p_value/0.9961/effect/activating
+- http://localhost:4001/N-N-C-C/p_value/0.9972/effect/activating
+- http://localhost:4001/C-N(-C-C)(-N)/p_value/0.9996/effect/activating
+- http://localhost:4001/N-N/p_value/0.9998/effect/activating
+http://localhost:4000/InChI=1S/C14H9Cl5/c15-11-5-1-9(2-6-11)13(14(17,18)19)10-3-7-12(16)8-4-10/h1-8,13H:
+- http://localhost:4001/Cl-C-Cl/p_value/0.7696/effect/deactivating
+- http://localhost:4001/C-C(-Cl)(-Cl)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/C=C-C=C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C=C)/p_value/0.9986/effect/deactivating
+- http://localhost:4001/C-C-C=C/p_value/0.9981/effect/deactivating
+- http://localhost:4001/C-C=C-C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C)/p_value/0.9991/effect/deactivating
+- http://localhost:4001/Cl-C-C/p_value/0.7721/effect/deactivating
+- http://localhost:4001/Cl-C-C-C/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C-C-C/p_value/0.9874/effect/deactivating
+- http://localhost:4001/C-C(-C-C)(-C-C)/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C-C(-C)(-C-C)/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C-C(-C)(-C)/p_value/0.995/effect/deactivating
+http://localhost:4000/InChI=1S/C15H10O7.2H2O/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6;;/h1-5,16-19,21H;2*1H2:
+- http://localhost:4001/O-C-C=O/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C=C-C=O/p_value/0.9996/effect/deactivating
+- http://localhost:4001/C-C-C=O/p_value/0.9998/effect/deactivating
+- http://localhost:4001/O-C=C-O/p_value/0.9417/effect/deactivating
+- http://localhost:4001/O-C-C=C-O/p_value/0.9417/effect/deactivating
+- http://localhost:4001/O-C-C=C-C=C-O/p_value/0.9685/effect/deactivating
+- http://localhost:4001/O-C=C-C=C-C=C-O/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C=C-C=C-C=C-O/p_value/0.8707/effect/deactivating
+- http://localhost:4001/C-C(-O)(=C-C=C-C=C-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C(=C-O)(-C=C-C=C-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C(-C=C-C=C-O)(=C-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C(=C-C=C-C=C-O)(-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C-C=C-C=C-C=C-O/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(-O)(=C-C=C-C=C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C(=C-O)(-C=C-C=C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C(-C=C-O)(=C-C=C-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(-C=C-O)(=C-C=C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(=C-C=C-O)(-C=C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C(-C=C-C=C-O)(=C-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(-O)(=C-C=C-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C(=C-O)(-C=C-C=C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(=C-O)(-C=C-C=C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/O-C(-C=C-O)(=C-C=C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(-C=C-O)(=C-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(=C-C=C-O)(-C=C)/p_value/0.983/effect/deactivating
+- http://localhost:4001/O-C(=C-O)(-C=C-C(=C)(-C))/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C-C=C-C=C-O/p_value/0.9286/effect/deactivating
+- http://localhost:4001/C-C(-O)(=C-C=C-C-C-O)/p_value/0.9685/effect/deactivating
+- http://localhost:4001/O-C(=C-O)(-C=C-C-C-O)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(=C-C=C-O)(-C-C-O)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/O=C(-C=C-C=C-O)(-C-O)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C=C-C-C=C-C=C-O/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(-O)(=C-C=C-C-C)/p_value/0.983/effect/deactivating
+- http://localhost:4001/O-C(=C-O)(-C=C-C-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/O-C(-C=C-O)(=C-C-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(=C-C=C-O)(-C-C)/p_value/0.9685/effect/deactivating
+- http://localhost:4001/C-C(-O)(=C-C=C-C)/p_value/0.9908/effect/deactivating
+- http://localhost:4001/O-C(=C-O)(-C=C-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(=C-O)(-C=C-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/O-C(-C=C-O)(=C-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(-C=C-O)(=C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(=C-C=C-O)(-C)/p_value/0.983/effect/deactivating
+- http://localhost:4001/O-C(=C(-O)(-C))(-C=C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(=C(-O)(-C))(-C=C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(-C=C(-O)(-C))(=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C(=C-O)(-C=C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(=C-O)(-C=C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(-C=C-O)(=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C-C-C=C-O/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C=C-C-C=C-O/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C-C-C=C-O/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(-O)(=C-C-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/O-C(=C-O)(-C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(=C-O)(-C-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(=C(-O)(-C))(-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(=C-O)(-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(-O)(=C)/p_value/0.7394/effect/deactivating
+- http://localhost:4001/C-C=C-C-O/p_value/0.9882/effect/deactivating
+- http://localhost:4001/C-C(-C=C-C-O)(=C-C)/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C-C(-C=C-C-O)(=C)/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C-C-C=C-C-O/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C-C(-C-O)(=C)/p_value/0.9882/effect/deactivating
+- http://localhost:4001/C-C-C-O/p_value/0.9675/effect/deactivating
+- http://localhost:4001/C-C=C-C=C-C-C-O/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C-C-C-C-O/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C=C-C=C-O-C/p_value/0.983/effect/deactivating
+- http://localhost:4001/C-C-C=C-O-C/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C-C(-O-C)(=C-C)/p_value/0.8707/effect/deactivating
+- http://localhost:4001/C-C(=C-O-C)(-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C=C-O-C=C/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-O-C(=C)(-C))(=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C-C=C-O-C-C/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C-C=C-O-C-C-C/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C=C(-O-C=C-C)(-C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-O-C-C-C)(=C-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(=C-O-C-C-C)(-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(-O-C-C)(=C-C)/p_value/0.983/effect/deactivating
+- http://localhost:4001/C-C(=C-O-C-C)(-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C=C-C=C-O-C-C=C/p_value/0.9685/effect/deactivating
+- http://localhost:4001/C-C-C=C-O-C-C=C/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C-C=C-O-C-C=C-C/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C=C(-O-C=C-C)(-C(=C-C)(-C))/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C=C-C(-C-O-C=C-C)(=C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C=C(-O-C=C-C)(-C=C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-O-C-C=C-C)(=C-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(=C-O-C-C=C-C)(-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C=C(-O-C=C-C)(-C(=C)(-C))/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C=C(-O-C=C-C)(-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-O-C-C=C)(=C-C)/p_value/0.9685/effect/deactivating
+- http://localhost:4001/C-C(=C-O-C-C=C)(-C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C-C=C-O-C-C=C-C=C/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C-C=C-O-C-C=C-C=C-C/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C(=C-C-O-C=C-C)(-C=C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C=C(-O-C=C-C)(-C=C-C=C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-O-C-C=C-C=C-C)(=C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(=C-O-C-C=C-C=C-C)(-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C(=C-C-O-C=C-C)(-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C=C(-O-C=C-C)(-C(=C-C=C)(-C))/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C=C-C(-C-O-C=C-C)(=C-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C=C(-O-C=C-C)(-C=C-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-O-C-C=C-C=C)(=C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(=C-O-C-C=C-C=C)(-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C-C=C-O-C-C=C-C=C-C=C/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C(=C-C=C-C-O-C=C-C)(-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C=C(-O-C=C-C)(-C=C-C(=C-C=C)(-O))/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-O-C-C=C-C(=C-C=C)(-O))(=C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(=C-O-C-C=C-C(=C-C=C)(-O))(-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C=C(-O-C=C-C)(-C=C-C=C-C=C)/p_value/0.8949/effect/deactivating
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+- http://localhost:4001/C-C=C(-O-C=C)(-C=C-C=C-C=C)/p_value/0.8949/effect/deactivating
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+- http://localhost:4001/C-C-C=C-C=C-C-O-C=C/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C=C(-O-C=C)(-C=C-C(=C-C)(-O))/p_value/0.8949/effect/deactivating
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+- http://localhost:4001/O-C(=C-C-O-C=C)(-C=C)/p_value/0.8949/effect/deactivating
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+- http://localhost:4001/C-C=C(-O-C=C)(-C=C-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C=C(-O-C=C)(-C=C-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-O-C-C=C-C=C)(=C)/p_value/0.8949/effect/deactivating
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+- http://localhost:4001/C=C-C(-C-O-C=C)(=C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C=C(-O-C=C)(-C=C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/O-C=C(-O-C=C)(-C=C-C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-O-C-C=C-C)(=C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(-O-C-C=C)(=C)/p_value/0.9685/effect/deactivating
+- http://localhost:4001/C=C-C-C-O-C=C/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-O-C-C-C)(=C)/p_value/0.9417/effect/deactivating
+- http://localhost:4001/C-C(-O-C-C)(=C)/p_value/0.983/effect/deactivating
+- http://localhost:4001/C-C=C-C-O-C/p_value/0.9608/effect/deactivating
+- http://localhost:4001/C-C-C=C-C=C-C-O-C/p_value/0.9685/effect/deactivating
+- http://localhost:4001/C-C-O-C-C=C-C=C/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C=C-C(-C-O-C)(=C-C=C)/p_value/0.9685/effect/deactivating
+- http://localhost:4001/C=C-C(-C-O-C)(=C-C)/p_value/0.9685/effect/deactivating
+- http://localhost:4001/C-C-O-C-C=C/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C-C(-C-O-C)(=C)/p_value/0.9608/effect/deactivating
+- http://localhost:4001/C-C-C-O-C/p_value/0.9784/effect/deactivating
+- http://localhost:4001/C-C-O-C-C/p_value/0.9367/effect/deactivating
+- http://localhost:4001/C-C-C-O-C-C/p_value/0.9908/effect/deactivating
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/C=C-C=C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C=C)/p_value/0.9986/effect/deactivating
+- http://localhost:4001/C-C-C=C/p_value/0.9981/effect/deactivating
+- http://localhost:4001/C-C=C-C/p_value/0.9984/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C)/p_value/0.9991/effect/deactivating
+- http://localhost:4001/C-C-C-C/p_value/0.9874/effect/deactivating
+http://localhost:4000/InChI=1S/C6H10N2O/c1-3-5-8(7-9)6-4-2/h3-4H,1-2,5-6H2:
+- http://localhost:4001/N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/N-N-C/p_value/0.9994/effect/activating
+- http://localhost:4001/C-N(-C)(-N)/p_value/0.9999/effect/activating
+- http://localhost:4001/C-N-C/p_value/0.9961/effect/activating
+- http://localhost:4001/N-N-C-C/p_value/0.9972/effect/activating
+- http://localhost:4001/C-N(-C-C)(-N)/p_value/0.9996/effect/activating
+- http://localhost:4001/N-N/p_value/0.9998/effect/activating
+http://localhost:4000/InChI=1S/C5H8O2/c1-4(2)5(6)7-3/h1H2,2-3H3:
+- http://localhost:4001/O-C=O/p_value/0.9792/effect/deactivating
+- http://localhost:4001/C-C(=O)(-O)/p_value/0.9985/effect/deactivating
+- http://localhost:4001/C=C-C=O/p_value/0.9996/effect/deactivating
+- http://localhost:4001/C-C-C=O/p_value/0.9998/effect/deactivating
+- http://localhost:4001/C-C(-C-O)(=C)/p_value/0.9882/effect/deactivating
+- http://localhost:4001/C-C-C-O/p_value/0.9675/effect/deactivating
+- http://localhost:4001/O=C(-O-C)(-C=C)/p_value/0.8949/effect/deactivating
+- http://localhost:4001/C-C(-C-O-C)(=C)/p_value/0.9608/effect/deactivating
+- http://localhost:4001/C-C-C-O-C/p_value/0.9784/effect/deactivating
+- http://localhost:4001/C=C/p_value/0.9949/effect/deactivating
+- http://localhost:4001/C-C=C/p_value/0.9956/effect/deactivating
+- http://localhost:4001/C-C(=C)(-C)/p_value/0.9991/effect/deactivating
+http://localhost:4000/InChI=1S/C6H10ClN3O3/c1-5(11)4-10(9-13)6(12)8-3-2-7/h2-4H2,1H3,(H,8,12):
+- http://localhost:4001/N-N-C-C=O/p_value/0.9708/effect/activating
+- http://localhost:4001/C-C(=O)(-C-N-C)/p_value/0.9708/effect/activating
+- http://localhost:4001/C-C(=O)(-C-N)/p_value/0.9822/effect/activating
+- http://localhost:4001/N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N-N=O/p_value/0.9997/effect/activating
+- http://localhost:4001/N=C-O/p_value/0.9495/effect/activating
+- http://localhost:4001/N-C(-O)(=N)/p_value/0.9708/effect/activating
+- http://localhost:4001/N-C-O/p_value/0.9994/effect/activating
+- http://localhost:4001/N-N-C=N-C-C/p_value/0.9522/effect/activating
+- http://localhost:4001/N-N-C=N-C/p_value/0.8121/effect/activating
+- http://localhost:4001/C-N(-C=N-C)(-N)/p_value/0.9223/effect/activating
+- http://localhost:4001/O-C(=N-C)(-N-N)/p_value/0.9223/effect/activating
+- http://localhost:4001/C-C-N-C=N-C-C/p_value/0.9223/effect/activating
+- http://localhost:4001/O-C(=N-C-C)(-N-C)/p_value/0.9223/effect/activating
+- http://localhost:4001/N-N(-C=N-C)(-C-C)/p_value/0.9223/effect/activating
+- http://localhost:4001/O-C(=N-C)(-N-C-C)/p_value/0.9223/effect/activating
+- http://localhost:4001/O-C(=N-C)(-N-C)/p_value/0.9223/effect/activating
+- http://localhost:4001/N-N-C=N/p_value/0.9281/effect/activating
+- http://localhost:4001/C-N(-C=N)(-N)/p_value/0.9708/effect/activating
+- http://localhost:4001/O-C(=N)(-N-N)/p_value/0.9708/effect/activating
+- http://localhost:4001/N-N-C/p_value/0.9994/effect/activating
+- http://localhost:4001/C-N(-C)(-N)/p_value/0.9999/effect/activating
+- http://localhost:4001/C-N-C/p_value/0.9961/effect/activating
+- http://localhost:4001/Cl-C-C/p_value/0.7721/effect/deactivating
+- http://localhost:4001/N-N-C-C/p_value/0.9972/effect/activating
+- http://localhost:4001/C-N(-C-C)(-N)/p_value/0.9996/effect/activating
+- http://localhost:4001/N-N-C-C-C/p_value/0.9856/effect/activating
+- http://localhost:4001/C-N(-C-C-C)(-N)/p_value/0.9909/effect/activating
+- http://localhost:4001/N-N/p_value/0.9998/effect/activating
diff --git a/features/data/kazius.csv b/features/data/kazius.csv
new file mode 100644
index 0000000..c1e8999
--- /dev/null
+++ b/features/data/kazius.csv
@@ -0,0 +1,4069 @@
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+OC2CC(O)(CC(OC(=O)C=CC1=CC(=C(C=C1)O)O)C2O)C(O)=O,false
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+CC12CCC(CC1)C(C)(C)O2,false
+CC12CCCC(C)(C1CCC34CC(=C)C(O)(CCC23)C4)C(O)=O,false
+CNC3=C1CC(=O)C(=CC=C1C2=C(C(=C(C=C2CC3)OC)OC)OC)OC,false
+CC34CC(O)C1C(CCC2=CC(=O)C=CC12C)C3CCC4(O)C(O)C=O,false
+CC34CCC1C(CCC2=C1C=CC(=C2)O)C3CC(O)C4O,false
+CC34CCC1C(CCC2=C1C=CC(=C2)O)C3CCC4O,false
+CC2=CN(C1CC(O)C(CO)O1)C(=O)NC2=O,false
+OC1=NC(=C(C=N1)F)O,false
+CC(=O)OC3(CCC4C2CCC1=C(CCC(=O)C1)C2CCC34C)C#C,false
+CC1CCC6(OC1)OC5CC4C3CC=C2CC(O)CCC2(C)C3CCC4(C)C5C6C,false
+CC4CC3OC1C(O)CC(C)(C12CO2)C3(CO)C(=O)C4=O,false
+OC3=C(C=C2C1C4=C(OCC1(CC2=C3)O)C(=C(O)C=C4)O)O,false
+COC1=C(C(=CC(=C1)C3C2C(COC2=O)C(O)C5=C3C=C4OCOC4=C5)OC)OC,false
+CC2OC=C1C(=O)C(C(O)=O)C(=O)C(=C1C2C)C,false
+NC2=C1C(=NN=C(C1=CC=C2)O)O,false
+CC34CCC1C(CC=C2CC(O)CCC12C)C3CCC4=O,false
+CN1CCCC1C2=CN=CC=C2,false
+OCC1OC(CC1O)N2C=C(I)C(=O)NC2=O,false
+CC(C)C12CC1C(C)C(=O)C2,false
+CC(N)(CC1=CC(=C(C=C1)O)O)C(O)=O,false
+CC1=NC(=NC(=C1)O)S,false
+CC34CCC1C(CCC2=C1C=CC(=C2)O)C3CCC4(O)C#C,false
+CC(=O)C3CCC4C2CC=C1CC(=O)CCC1(C)C2CCC34C,false
+NC2=C1N=C[N](C1=NC=N2)C3OC(CO)C(O)C3O,false
+OC(=O)CCCCC1SCC2NC(=O)NC12,false
+NS(=O)(=O)C1=C(C=C2C(=C1)S(NC=N2)(=O)=O)Cl,false
+SC2=NC1=CC=CC=C1[NH]2,false
+OCC1OC(CC1O)N2C=C(Br)C(=O)NC2=O,false
+NC2=NC1=NC=C(N=C1C(=N2)O)CNC3=CC=C(C=C3)C(=O)NC(CCC(O)=O)C(O)=O,false
+CC1=C(N=C(N=C1)S)O,false
+CC=CC(=O)OC2CC3OC1=CC(C)C(=O)CC1(C)C2(C)C34CO4,false
+CC(C)CCCC(C)C1CCC2C(CCCC12C)=CC=C3CC(O)CCC3=C,false
+NC(CC1=CC=CC=C1)C(O)=O,false
+CC34CCC1C(CC=C2CC(=O)CCC12)C3CCC4(O)C#C,false
+CC(=O)OC3(CCC4C2CC(=C1CC(=O)CCC1(C)C2CCC34C)C)C(C)=O,false
+CC14C(O)C=CC5(OC1=O)C2CCC3(O)CC2(CC3=C)C(C45)C(O)=O,false
+C2C=CC3C1CC(C=C1)C23,false
+CC1=CCC2CC1C2(C)C,false
+CC6CCC5C(C)C3C(CC4C2CC=C1CC(O)CCC1(C)C2CCC34C)N5C6,false
+CC(CCC(O)=O)C3CCC4C2C(O)CC1CC(O)CCC1(C)C2CC(O)C34C,false
+[O-][N+](=O)OC1COC2C(COC12)O[N+]([O-])=O,false
+CC2=CCCC(=C)C1CC(C)(C)C1CC2,false
+CC1=C(N=C(N=N1)O)O,false
+OCC1OC(CC1O)N2C=CC(=O)NC2=O,false
+NC2=C1N=C[N](C1=NC=N2)C3CC(O)C(CO)O3,false
+CCCC(=O)OCC,false
+CC(=O)C1=CC=NC=C1,false
+ClC1=NC(=CC=C1)Cl,false
+CC(O)CO,false
+CC(C)CO,false
+CC1CCC(=O)C1=O,false
+CC1=CC(=O)OC2=C1C=CC(=C2)O,false
+CCN(CC)C1=CC=CC=C1,false
+CCCCOC(=O)C(C)=C,false
+CN(C)C(=O)OC1=C[N+](=CC=C1)C,false
+CCC(CO)NCCNC(CC)CO,false
+CC12CCC(CC1O2)C=C,false
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+CCCCCC(=O)OC3(CCC4C2CCC1=C(CCC(=O)C1)C2CCC34C)C(C)=O,false
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+CCCCCCCCCCCCOS(O)(=O)=O,false
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+CN2CCN=C(C1=CC=CC=C1)C3=C2C=CC(=C3)Cl,false
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+NC1=CC(=C(C=C1)Cl)C(F)(F)F,false
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+OC2=C1C=CC=CC1=NC=N2,false
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+CCCCCCC(O)CC=CCCCCCCCC(O)=O,false
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+OC(=O)C1=C(C=CC=C1)O,false
+NC2=NC1=CC=C(C=C1[NH]2)Cl,false
+CCCOC(C(=O)OC1CCN(C)CC1)(C2=CC=CC=C2)C3=CC=CC=C3,false
+NC3=NC(=C2N=C[N](C1OC(COP(O)(O)=O)C(O)C1O)C2=N3)O,false
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+CC1=CC(=C(C=C1)N=NC3=C2C=CC=CC2=CC(=C3O)C(O)=O)S(O)(=O)=O,false
+CN,false
+CC1=C(C(=CC=C1)OCC(O)CNC(C)(C)C)C,false
+CN[N+]([O-])=O,false
+ClC4=C(Cl)C5(Cl)C3C1CC(C2OC12)C3C4(Cl)C5(Cl)Cl,false
+CC(C)CC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)CN)C(O)=O,false
+CC1=NCCC2=C1[NH]C3=CC(=CC=C23)O,false
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+CNCC(O)C1=CC(=CC=C1)O,false
+NC1=NC=N[NH]1,false
+NC1=NC(=O)N(C=C1I)C2CC(O)C(CO)O2,false
+NC(CC1=CC(=C(C=C1)O)[N+]([O-])=O)C(O)=O,false
+COC1=CC=C(C=C1)CN(CCN(C)C)C2=NC=CC=N2,false
+CN(C)C4C3CC2C(C(=O)C1=C(C=CC=C1O)C2(C)O)C(=O)C3(O)C(=O)C(C(N)=O)C4=O,false
+COC1=CC=C2C(=CC1=O)C(CCC3=C2C(=C(C(=C3)OC)OC)OC)NC(C)=O,false
+CN1C2CC(CC1C3OC23)OC(=O)C(CO)C4=CC=CC=C4,false
+CNC(C=[N+](O)[O-])=NCCSCC1=CC=C(O1)CN(C)C,false
+OCC1OC(C(O)C1O)N2C=CC(=N)NC2=O,false
+OC1=NC(=NC=N1)O,false
+CC2(C)C1CCC(C1)C2=C,false
+CCCCCCCCCCCCOCCOCCOCCOCCOCCOCCOCCO,false
+OCC1=CC(C(O)C1O)N2C=CC(=N)NC2=O,false
+O=C1NC(=S)NC(=O)C1C(=O)NC2=CC=CC=C2,false
diff --git a/features/dataset.feature b/features/dataset.feature
new file mode 100644
index 0000000..af667ea
--- /dev/null
+++ b/features/dataset.feature
@@ -0,0 +1,39 @@
+@rest
+Feature: Dataset
+
+ Scenario Outline: Create dataset
+ Given name is <name>
+ When I post the parameters to the dataset webservice
+ Then I should receive a valid URI
+ And the URI should contain <name>
+
+ Examples:
+ |name|
+ |Test|
+ |Rodent Carcinogenicity|
+
+
+ Scenario Outline: Add data to a dataset
+ Given name is <name>
+ And compound_format is smiles
+ And a file <filename>
+ When I post the parameters to the dataset webservice
+ And I put the file to the dataset URI
+ Then I should receive a valid URI
+ And the URI should return a YAML representation
+
+ Examples:
+ |name|filename|
+ |Hamster Carcinogenicity|hamster_carcinogenicity.csv|
+
+ Scenario Outline: Add YAML data
+ Given name is <name>
+ Given a file <filename>
+ When I post the parameters to the dataset webservice
+ And I put YAML data to the dataset URI
+ Then I should receive a valid URI
+ And the URI should return a YAML representation
+
+ Examples:
+ |name|filename|
+ |Hamster Carcinogenicity BBRC features|hamster_carcinogenicity_bbrc_features.yaml|
diff --git a/features/dataset_large.feature b/features/dataset_large.feature
new file mode 100644
index 0000000..d847522
--- /dev/null
+++ b/features/dataset_large.feature
@@ -0,0 +1,15 @@
+@rest
+Feature: Dataset
+
+ Scenario Outline: Add data to a dataset
+ Given name is <name>
+ And compound_format is smiles
+ And a file <filename>
+ When I post the parameters to the dataset webservice
+ And I put the file to the dataset URI
+ Then I should receive a valid URI
+ And the URI should return a YAML representation
+
+ Examples:
+ |name|filename|
+ |Salmonella mutagenicity|kazius.csv|
diff --git a/features/feature.feature b/features/feature.feature
new file mode 100644
index 0000000..cf8b35e
--- /dev/null
+++ b/features/feature.feature
@@ -0,0 +1,13 @@
+@rest
+Feature: Create feature URI
+
+ Scenario Outline: Create URIs
+ Given name is <name>
+ And <property> is <value>
+ When I post the parameters to the feature webservice
+ Then I should receive a valid URI
+ And the URI should contain <result>
+
+ Examples:
+ |name |property |value |result|
+ |Rodent carcinogenicity|classification|active|Rodent carcinogenicity/classification/active|
diff --git a/features/fminer.feature b/features/fminer.feature
new file mode 100644
index 0000000..0b66b51
--- /dev/null
+++ b/features/fminer.feature
@@ -0,0 +1,16 @@
+@rest
+Feature: Fminer
+
+ Scenario Outline: Add data to a dataset
+ Given name is <name>
+ And compound_format is smiles
+ And a file <filename>
+ When I apply fminer
+ Then I should receive a valid URI
+ And the URI should return a YAML representation
+
+ Examples:
+ |name |filename |
+ |Hamster Carcinogenicity|hamster_carcinogenicity.csv|
+ #|Salmonella mutagenicity|kazius.csv|
+
diff --git a/features/lazar.feature b/features/lazar.feature
new file mode 100644
index 0000000..0a2ff45
--- /dev/null
+++ b/features/lazar.feature
@@ -0,0 +1,17 @@
+@rest
+Feature: Create a model and predict an unknown compound
+ As a toxicologist
+ I want to create a lazar model
+ In order to predict the toxicity of a compound
+
+ Scenario Outline:
+ Given name is <name>
+ And compound_format is smiles
+ And a file <filename>
+ When I create a lazar model
+ Then I should receive a valid URI
+ And the model should predict <prediction> for <smiles>
+
+ Examples:
+ |name |filename |smiles |prediction|
+ |Hamster Carcinogenicity|hamster_carcinogenicity.csv|c1ccccc1NN|true |
diff --git a/features/step_definitions/.lazar_steps.rb.swp b/features/step_definitions/.lazar_steps.rb.swp
new file mode 100644
index 0000000..c4fd3ef
--- /dev/null
+++ b/features/step_definitions/.lazar_steps.rb.swp
Binary files differ
diff --git a/features/step_definitions/common_steps.rb b/features/step_definitions/common_steps.rb
new file mode 100644
index 0000000..e0437f5
--- /dev/null
+++ b/features/step_definitions/common_steps.rb
@@ -0,0 +1,24 @@
+Given /^(.*) is (.*)$/ do |name,value|
+ @params = {} unless @params
+ @params[name] = value
+end
+
+When /^I post the parameters to the (.*) webservice$/ do |component|
+ @uri = RestClient.post @@config[:services]["opentox-#{component}"], @params
+ @resources << @uri unless /compound|feature/ =~ component
+end
+
+Then /^I should receive a valid URI$/ do
+ @response = RestClient.get @uri
+end
+
+Then /^the URI should contain (.+)$/ do |result|
+ #puts @uri
+ regexp = /#{Regexp.escape(URI.encode(result))}/
+ assert regexp =~ @uri, true
+end
+
+Then /^the URI response should be (\S+)$/ do |result|
+ assert result == @response, true
+end
+
diff --git a/features/step_definitions/dataset_steps.rb b/features/step_definitions/dataset_steps.rb
new file mode 100644
index 0000000..0ba0f96
--- /dev/null
+++ b/features/step_definitions/dataset_steps.rb
@@ -0,0 +1,26 @@
+Given /^a file (.*)$/ do |filename|
+ @filename = File.join(File.dirname(__FILE__),'..','data', filename)
+end
+
+When /^I put the file to the dataset URI$/ do
+ call = "curl -X PUT -F 'file=@#{@filename};type=text/csv' -F compound_format=#{@params['compound_format']} #{@uri + '/import'}"
+ @uri = `#{call}`
+end
+
+Then /^the URI should return a YAML representation$/ do
+ valid_yaml = false
+ begin
+ @yaml_string = RestClient.get(@uri)
+ yaml = YAML.load(@yaml_string)
+ valid_yaml = true
+ rescue
+ end
+ assert valid_yaml, true
+ #puts @yaml_string
+end
+
+When /^I put YAML data to the dataset URI$/ do
+ yaml = File.read(@filename)
+ RestClient.put @uri, :features => yaml
+end
+
diff --git a/features/step_definitions/fminer_step.rb b/features/step_definitions/fminer_step.rb
new file mode 100644
index 0000000..0e8b79b
--- /dev/null
+++ b/features/step_definitions/fminer_step.rb
@@ -0,0 +1,7 @@
+When /^I apply fminer$/ do
+ @training_uri = RestClient.post @@config[:services]["opentox-dataset"], @params
+ @resources << @training_uri
+ call = "curl -X PUT -F 'file=@#{@filename};type=text/csv' -F compound_format=#{@params['compound_format']} #{@training_uri + '/import'}"
+ `#{call}`
+ @uri = RestClient.post File.join(@@config[:services]["opentox-algorithm"], "fminer"), :dataset_uri => @training_uri
+end
diff --git a/features/step_definitions/lazar_steps.rb b/features/step_definitions/lazar_steps.rb
new file mode 100644
index 0000000..402f8db
--- /dev/null
+++ b/features/step_definitions/lazar_steps.rb
@@ -0,0 +1,18 @@
+When /^I create a lazar model$/ do
+ @training_uri = RestClient.post @@config[:services]["opentox-dataset"], @params
+ @resources << @training_uri
+ call = "curl -X PUT -F 'file=@#{@filename};type=text/csv' -F compound_format=#{@params['compound_format']} #{@training_uri + '/import'}"
+ `#{call}`
+ @feature_uri = RestClient.post File.join(@@config[:services]["opentox-algorithm"], "fminer"), :dataset_uri => @training_uri
+ @resources << @feature_uri
+ @uri = RestClient.post File.join(@@config[:services]["opentox-algorithm"], "lazar_classification"), :activity_dataset_uri => @training_uri, :feature_dataset_uri => @feature_uri
+ @resources << @uri
+end
+
+Then /^the model should predict (.*) for (.*)$/ do |activity,smiles|
+ compound_uri = OpenTox::Compound.new(:smiles => smiles).uri
+ prediction_uri = RestClient.post @uri, :compound_uri => compound_uri
+ prediction = RestClient.get prediction_uri
+ assert_equal activity.to_s, YAML.load(prediction)[:values]['classification'].to_s
+end
+
diff --git a/features/support/env.rb b/features/support/env.rb
new file mode 100644
index 0000000..098bc71
--- /dev/null
+++ b/features/support/env.rb
@@ -0,0 +1,5 @@
+require 'opentox-ruby-api-wrapper'
+require 'test/unit/assertions'
+
+World(Test::Unit::Assertions)
+
diff --git a/features/support/hooks.rb b/features/support/hooks.rb
new file mode 100644
index 0000000..7b376c4
--- /dev/null
+++ b/features/support/hooks.rb
@@ -0,0 +1,14 @@
+Before do
+ @resources = []
+end
+
+After do |scenario|
+ @resources.uniq!
+ @resources.each do |resource|
+ begin
+ RestClient.delete resource
+ rescue
+ puts "Cannot delete " + resource
+ end
+ end
+end
generated by cgit v1.2.3 (git 2.25.1) at 2024-05-20 20:04:19 +0000