Removed old datasets_nestle backup and added an new backup

2 files changed, 78 insertions, 67 deletions

diff --git a/5x_cv/datasets_nestle_dv.yaml b/5x_cv/datasets_nestle_dv.yaml
new file mode 100644
index 0000000..b42b47a
--- /dev/null
+++ b/5x_cv/datasets_nestle_dv.yaml
@@ -0,0 +1,78 @@
+{
+
+  "MDD": {   #fda_dose_mrdd_mmol.csv
+    "dataset": "http://toxcreate3.in-silico.ch:8086/dataset/1571",
+    "electronic,cpsa": "http://toxcreate3.in-silico.ch:8086/dataset/4007",
+    "constitutional": "http://toxcreate3.in-silico.ch:8086/dataset/4006",
+    "constitutional,electronic,cpsa": "http://toxcreate3.in-silico.ch:8086/dataset/5265"
+  },
+  
+  "FHM": {   #EPA_v4b_Fathead_Minnow_Acute_Toxicity_LC50_mmol.csv
+    "dataset": "http://toxcreate3.in-silico.ch:8086/dataset/1572",
+    "electronic,cpsa": "http://toxcreate3.in-silico.ch:8086/dataset/4019",
+    "constitutional": "http://toxcreate3.in-silico.ch:8086/dataset/4008"
+  },
+  
+  "RAT": {   #CPDBAS_v5d_20Nov2008_rat_TD50.csv
+    "dataset": "http://toxcreate3.in-silico.ch:8086/dataset/1573",
+    "electronic,cpsa": "http://toxcreate3.in-silico.ch:8086/dataset/4077",
+    "constitutional": "http://toxcreate3.in-silico.ch:8086/dataset/4020"
+  },
+  
+  "MOU": {   #CPDBAS_v5d_20Nov2008_mouse_TD50.csv
+    "dataset": "http://toxcreate3.in-silico.ch:8086/dataset/1574",
+    "electronic,cpsa": "http://toxcreate3.in-silico.ch:8086/dataset/4115",
+    "constitutional": "http://toxcreate3.in-silico.ch:8086/dataset/4101"
+  },
+
+  "FHM_outl": {   #FHM2   EPA v4b Fathead Minnow Acute Toxicity LC50_mmol_outl.csv
+    "dataset": "http://toxcreate3.in-silico.ch:8086/dataset/4975",
+    "electronic,cpsa": "http://toxcreate3.in-silico.ch:8086/dataset/5263",
+    "constitutional": "http://toxcreate3.in-silico.ch:8086/dataset/5262",
+    "constitutional,electronic,cpsa": "http://toxcreate3.in-silico.ch:8086/dataset/5266"
+  },
+
+  "RAT_outl": {   #RAT2   CPDBAS_v5d_20Nov2008_rat_TD50_outl.csv
+    "dataset": "http://toxcreate3.in-silico.ch:8086/dataset/4977",
+    "electronic,cpsa": "http://toxcreate3.in-silico.ch:8086/dataset/5253",
+    "constitutional": "http://toxcreate3.in-silico.ch:8086/dataset/5246",
+    "constitutional,electronic,cpsa": "http://toxcreate3.in-silico.ch:8086/dataset/5254"
+  },
+
+  "MOU_outl": {   #MOU2   CPDBAS_v5d_20Nov2008_mouse_TD50_outl.csv
+    "dataset": "http://toxcreate3.in-silico.ch:8086/dataset/4976",
+    "electronic,cpsa": "http://toxcreate3.in-silico.ch:8086/dataset/5267",
+    "constitutional": "http://toxcreate3.in-silico.ch:8086/dataset/5264",
+    "constitutional,electronic,cpsa": "http://toxcreate3.in-silico.ch:8086/dataset/5198"
+  },
+
+  "RAT_pTD": {   #Bercu_CPDB_9March2010_rat_pTD50.csv
+    "dataset": "http://toxcreate3.in-silico.ch:8086/dataset/5458",
+    "electronic,cpsa": "http://toxcreate3.in-silico.ch:8086/dataset/5463",
+    "constitutional": "http://toxcreate3.in-silico.ch:8086/dataset/5462",
+    "topological": "http://toxcreate3.in-silico.ch:8086/dataset/5477",
+    "constitutional,electronic,cpsa": "http://toxcreate3.in-silico.ch:8086/dataset/5464"
+  },
+
+  "MOU_pTD": {   #Bercu_CPDB_9March2010_mouse_pTD50.csv
+    "dataset": "http://toxcreate3.in-silico.ch:8086/dataset/5457",
+    "electronic,cpsa": "http://toxcreate3.in-silico.ch:8086/dataset/5460",
+    "constitutional": "http://toxcreate3.in-silico.ch:8086/dataset/5459",
+    "topological": "http://toxcreate3.in-silico.ch:8086/dataset/5476",
+    "constitutional,electronic,cpsa": "http://toxcreate3.in-silico.ch:8086/dataset/5461"
+  },
+
+  "FHM_LOG": {   #EPA_v4b_Fathead_Minnow_Acute_Toxicity_LC50_LOGINV_mmol_oul.csv
+    "dataset": "http://toxcreate3.in-silico.ch:8086/dataset/5473",
+    "electronic,cpsa": "http://toxcreate3.in-silico.ch:8086/dataset/5263",
+    "constitutional": "http://toxcreate3.in-silico.ch:8086/dataset/5262",
+    "constitutional,electronic,cpsa": "http://toxcreate3.in-silico.ch:8086/dataset/5266"
+  },
+
+  "MDD_LOG": {   #FDA_v3b_Maximum_Recommended_Daily_Dose_LOGINV_mmol_outl.csv
+    "dataset": "http://toxcreate3.in-silico.ch:8086/dataset/5474",
+    "electronic,cpsa": "http://toxcreate3.in-silico.ch:8086/dataset/5478",
+    "constitutional": "http://toxcreate3.in-silico.ch:8086/dataset/5475" #,
+#    "constitutional,electronic,cpsa": "http://toxcreate3.in-silico.ch:8086/dataset/"
+  }
+}
diff --git a/5x_cv/datasets_nestle_outl.yaml b/5x_cv/datasets_nestle_outl.yaml
deleted file mode 100644
index 5ef4ea1..0000000
--- a/5x_cv/datasets_nestle_outl.yaml
+++ /dev/null
@@ -1,67 +0,0 @@
-{
-
-  "MDD": {
-    "dataset": "http://toxcreate3.in-silico.ch:8086/dataset/1571",
-    "electronic,cpsa": "http://toxcreate3.in-silico.ch:8086/dataset/4007",
-    "constitutional": "http://toxcreate3.in-silico.ch:8086/dataset/4006",
-#    "geometrical":  "http://toxcreate3.in-silico.ch:8086/dataset/1905",
-#    "topological": "http://toxcreate3.in-silico.ch:8086/dataset/1906",
-#    "hybrid": "http://toxcreate3.in-silico.ch:8086/dataset/1907",
-    "constitutional,electronic,cpsa": "http://toxcreate3.in-silico.ch:8086/dataset/5265"
-  },
-  
-  "FHM": {
-    "dataset": "http://toxcreate3.in-silico.ch:8086/dataset/1572",
-    "electronic,cpsa": "http://toxcreate3.in-silico.ch:8086/dataset/4019",
-    "constitutional": "http://toxcreate3.in-silico.ch:8086/dataset/4008" #,
-#    "geometrical":  "http://toxcreate3.in-silico.ch:8086/dataset/1908",
-#    "topological": "http://toxcreate3.in-silico.ch:8086/dataset/1909",
-#    "hybrid": "http://toxcreate3.in-silico.ch:8086/dataset/1910"
-  },
-  
-  "RAT": {
-    "dataset": "http://toxcreate3.in-silico.ch:8086/dataset/1573",
-    "electronic,cpsa": "http://toxcreate3.in-silico.ch:8086/dataset/4077",
-    "constitutional": "http://toxcreate3.in-silico.ch:8086/dataset/4020" #,
-#    "geometrical":  "http://toxcreate3.in-silico.ch:8086/dataset/1911",
-#    "topological": "http://toxcreate3.in-silico.ch:8086/dataset/1912",
-#    "hybrid": "http://toxcreate3.in-silico.ch:8086/dataset/1913"
-  },
-  
-  "MOU": {
-    "dataset": "http://toxcreate3.in-silico.ch:8086/dataset/1574",
-    "electronic,cpsa": "http://toxcreate3.in-silico.ch:8086/dataset/4115",
-    "constitutional": "http://toxcreate3.in-silico.ch:8086/dataset/4101" #,
-#    "geometrical":  "http://toxcreate3.in-silico.ch:8086/dataset/1914",
-#    "topological": "http://toxcreate3.in-silico.ch:8086/dataset/1915",
-#    "hybrid": "http://toxcreate3.in-silico.ch:8086/dataset/1916"
-  },
-
-#  "MDD2": {
-#    "dataset": "http://toxcreate3.in-silico.ch:8086/dataset/",
-#    "electronic,cpsa": "http://toxcreate3.in-silico.ch:8086/dataset/",
-#    "constitutional": "http://toxcreate3.in-silico.ch:8086/dataset/",
-#    "constitutional,electronic,cpsa": "http://toxcreate3.in-silico.ch:8086/dataset/"
-#  },
-#  
-  "FHM2": {
-    "dataset": "http://toxcreate3.in-silico.ch:8086/dataset/4975",
-    "electronic,cpsa": "http://toxcreate3.in-silico.ch:8086/dataset/5263",
-    "constitutional": "http://toxcreate3.in-silico.ch:8086/dataset/5262",
-    "constitutional,electronic,cpsa": "http://toxcreate3.in-silico.ch:8086/dataset/5266"
-  },
-  
-  "RAT2": {
-    "dataset": "http://toxcreate3.in-silico.ch:8086/dataset/4977",
-    "electronic,cpsa": "http://toxcreate3.in-silico.ch:8086/dataset/5253",
-    "constitutional": "http://toxcreate3.in-silico.ch:8086/dataset/5246",
-    "constitutional,electronic,cpsa": "http://toxcreate3.in-silico.ch:8086/dataset/5254"
-  },
-  
-  "MOU2": {
-    "dataset": "http://toxcreate3.in-silico.ch:8086/dataset/4976",
-    "electronic,cpsa": "http://toxcreate3.in-silico.ch:8086/dataset/5267",
-    "constitutional": "http://toxcreate3.in-silico.ch:8086/dataset/5264",
-    "constitutional,electronic,cpsa": "http://toxcreate3.in-silico.ch:8086/dataset/5198"
-  }
-}