diff options
Diffstat (limited to 'features/compound.feature')
| -rw-r--r-- | features/compound.feature | 18 |
1 files changed, 0 insertions, 18 deletions
diff --git a/features/compound.feature b/features/compound.feature deleted file mode 100644 index f628f4b..0000000 --- a/features/compound.feature +++ /dev/null @@ -1,18 +0,0 @@ -@rest -Feature: Create compound URI - - Scenario Outline: Create and get URIs - Given Content-Type is <mime-type> - When I post <descriptor> 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 |mime-type |inchi |cansmi | - |F[B-](F)(F)F.[Na+] |chemical/x-daylight-smiles|InChI=1S/BF4.Na/c2-1(3,4)5;/q-1;+1 |[Na+].F[B-](F)(F)F | - |CC(=O)CC(C)C#N |chemical/x-daylight-smiles|InChI=1S/C6H9NO/c1-5(4-7)3-6(2)8/h5H,3H2,1-2H3 |CC(CC(=O)C)C#N | - |Benzene |text/plain |InChI=1S/C6H6/c1-2-4-6-5-3-1/h1-6H |c1ccccc1 | - |N#[N+]C1=CC=CC=C1.F[B-](F)(F)F |chemical/x-daylight-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|chemical/x-inchi |InChI=1S/C6H6/c1-2-4-6-5-3-1/h1-6H |c1ccccc1 | - |