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authorgebele <gebele@in-silico.ch>2017-08-08 14:52:42 +0000
committergebele <gebele@in-silico.ch>2017-08-08 14:52:42 +0000
commit230602246a08eb5fe8a4cbf7dbc956f87d5f62f4 (patch)
treed56ebab5311469b934576674217b724c0b3f8bef
parentd62e11dd1e48a4aeb03a7daf497a29f84b25a360 (diff)
added qmrf metadata
-rw-r--r--classification/DSSTox_Carcinogenic_Potency_DBS_Mouse.json6
-rw-r--r--classification/DSSTox_Carcinogenic_Potency_DBS_MultiCellCall.json6
-rw-r--r--classification/DSSTox_Carcinogenic_Potency_DBS_Rat.json9
-rw-r--r--classification/blood-brain-barrier.json6
-rw-r--r--classification/mutagenicity.json6
-rw-r--r--regression/EPAFHM_log10.json6
-rw-r--r--regression/FDA_v3b_Maximum_Recommended_Daily_Dose_mmol_log10.json6
-rw-r--r--regression/daphnia_magna_mmol_log10.json6
8 files changed, 42 insertions, 9 deletions
diff --git a/classification/DSSTox_Carcinogenic_Potency_DBS_Mouse.json b/classification/DSSTox_Carcinogenic_Potency_DBS_Mouse.json
index 02113d4..0add3c0 100644
--- a/classification/DSSTox_Carcinogenic_Potency_DBS_Mouse.json
+++ b/classification/DSSTox_Carcinogenic_Potency_DBS_Mouse.json
@@ -1,5 +1,9 @@
{
"species": "Mouse",
"endpoint": "Carcinogenicity",
- "source": "http://www.epa.gov/ncct/dsstox/sdf_cpdbas.html"
+ "source": "http://www.epa.gov/ncct/dsstox/sdf_cpdbas.html",
+ "qmrf": {
+ "group": "QMRF 4.12. Carcinogenicity",
+ "name": "OECD 451 Carcinogenicity Studies"
+ }
}
diff --git a/classification/DSSTox_Carcinogenic_Potency_DBS_MultiCellCall.json b/classification/DSSTox_Carcinogenic_Potency_DBS_MultiCellCall.json
index 5c725db..bbc97d5 100644
--- a/classification/DSSTox_Carcinogenic_Potency_DBS_MultiCellCall.json
+++ b/classification/DSSTox_Carcinogenic_Potency_DBS_MultiCellCall.json
@@ -1,4 +1,8 @@
{ "species": "Rodents (multiple species/sites)",
"endpoint": "Carcinogenicity",
- "source": "http://www.epa.gov/ncct/dsstox/sdf_cpdbas.html"
+ "source": "http://www.epa.gov/ncct/dsstox/sdf_cpdbas.html",
+ "qmrf": {
+ "group": "QMRF 4.12. Carcinogenicity",
+ "name": "OECD 451 Carcinogenicity Studies"
+ }
}
diff --git a/classification/DSSTox_Carcinogenic_Potency_DBS_Rat.json b/classification/DSSTox_Carcinogenic_Potency_DBS_Rat.json
index 5ea1e76..e2f3894 100644
--- a/classification/DSSTox_Carcinogenic_Potency_DBS_Rat.json
+++ b/classification/DSSTox_Carcinogenic_Potency_DBS_Rat.json
@@ -1,3 +1,8 @@
{ "species": "Rat",
-"endpoint": "Carcinogenicity",
-"source": "http://www.epa.gov/ncct/dsstox/sdf_cpdbas.html" }
+ "endpoint": "Carcinogenicity",
+ "source": "http://www.epa.gov/ncct/dsstox/sdf_cpdbas.html",
+ "qmrf": {
+ "group": "QMRF 4.12. Carcinogenicity",
+ "name": "OECD 451 Carcinogenicity Studies"
+ }
+}
diff --git a/classification/blood-brain-barrier.json b/classification/blood-brain-barrier.json
index b271ec1..87906d6 100644
--- a/classification/blood-brain-barrier.json
+++ b/classification/blood-brain-barrier.json
@@ -1,5 +1,9 @@
{
"species": "Human",
"endpoint": "Blood Brain Barrier Penetration",
- "source": "http://cheminformatics.org/datasets/"
+ "source": "http://cheminformatics.org/datasets/",
+ "qmrf": {
+ "group": "QMRF 5. Toxicokinetics",
+ "name": "QMRF 5.4. Toxicokinetics.Blood-brain barrier penetration"
+ }
}
diff --git a/classification/mutagenicity.json b/classification/mutagenicity.json
index b7344d7..2f27323 100644
--- a/classification/mutagenicity.json
+++ b/classification/mutagenicity.json
@@ -1,5 +1,9 @@
{
"species": "Salmonella typhimurium",
"endpoint": "Mutagenicity",
- "source": "http://pubs.acs.org/doi/full/10.1021/ci900161g"
+ "source": "http://pubs.acs.org/doi/full/10.1021/ci900161g",
+ "qmrf": {
+ "group": "QMRF 4.10. Mutagenicity",
+ "name": "OECD 471 Bacterial Reverse Mutation Test"
+ }
}
diff --git a/regression/EPAFHM_log10.json b/regression/EPAFHM_log10.json
index 11f4371..c6a242d 100644
--- a/regression/EPAFHM_log10.json
+++ b/regression/EPAFHM_log10.json
@@ -1,5 +1,9 @@
{ "species": "Fathead minnow",
"endpoint": "Acute toxicity",
"source": "http://www.epa.gov/comptox/dsstox/sdf_epafhm.html",
- "unit": "mmol/L"
+ "unit": "mmol/L",
+ "qmrf": {
+ "group": "QMRF 3.3. Acute toxicity to fish (lethality)",
+ "name": "EC C. 1. Acute Toxicity for Fish"
+ }
}
diff --git a/regression/FDA_v3b_Maximum_Recommended_Daily_Dose_mmol_log10.json b/regression/FDA_v3b_Maximum_Recommended_Daily_Dose_mmol_log10.json
index accbe49..1aaed3b 100644
--- a/regression/FDA_v3b_Maximum_Recommended_Daily_Dose_mmol_log10.json
+++ b/regression/FDA_v3b_Maximum_Recommended_Daily_Dose_mmol_log10.json
@@ -1,5 +1,9 @@
{ "species": "Human",
"endpoint": "Maximum Recommended Daily Dose",
"source": "http://www.epa.gov/comptox/dsstox/sdf_fdamdd.html",
- "unit": "mmol/kg-bw/day"
+ "unit": "mmol/kg-bw/day",
+ "qmrf": {
+ "group": "QMRF 4.14. Repeated dose toxicity",
+ "name": "OECD 452 Chronic Toxicity Studies"
+ }
}
diff --git a/regression/daphnia_magna_mmol_log10.json b/regression/daphnia_magna_mmol_log10.json
index 76dbda7..72a258d 100644
--- a/regression/daphnia_magna_mmol_log10.json
+++ b/regression/daphnia_magna_mmol_log10.json
@@ -1,5 +1,9 @@
{ "species": "Daphnia magna",
"endpoint": "Acute toxicity",
"source": "http://michem.disat.unimib.it/chm/download/toxicity.htm",
- "unit": "mmol/L"
+ "unit": "mmol/L",
+ "qmrf": {
+ "group": "QMRF 3.1. Short-term toxicity to Daphnia (immobilisation)",
+ "name": "EC C. 2. Daphnia sp Acute Immobilisation Test"
+ }
}