From 5f99b47b106af84423fc38de9315c23dec740d1b Mon Sep 17 00:00:00 2001 From: Ayush Noori Date: Wed, 20 Dec 2023 06:19:53 -0500 Subject: [PATCH] Remove B3DB from ADMET benchmark group --- tdc/metadata.py | 6 ------ 1 file changed, 6 deletions(-) diff --git a/tdc/metadata.py b/tdc/metadata.py index c015d478..9ad5f686 100644 --- a/tdc/metadata.py +++ b/tdc/metadata.py @@ -300,8 +300,6 @@ "lipophilicity_astrazeneca", "solubility_aqsoldb", "bbb_martins", - "b3db_classification", - "b3db_regression", "ppbr_az", "vdss_lombardo", "cyp2d6_veith", @@ -387,8 +385,6 @@ "lipophilicity_astrazeneca": "mae", "solubility_aqsoldb": "mae", "bbb_martins": "roc-auc", - "b3db_classification": "roc-auc", - "b3db_regression": "mae", "ppbr_az": "mae", "vdss_lombardo": "spearman", "cyp2c9_veith": "pr-auc", @@ -434,8 +430,6 @@ "lipophilicity_astrazeneca": "scaffold", "solubility_aqsoldb": "scaffold", "bbb_martins": "scaffold", - "b3db_classification": "scaffold", - "b3db_regression": "scaffold", "ppbr_az": "scaffold", "vdss_lombardo": "scaffold", "cyp2c9_veith": "scaffold",