From 66f2631bdf18bffe4e7600c74e121e2c2b76f705 Mon Sep 17 00:00:00 2001 From: Andreas Maunz Date: Mon, 20 Feb 2012 16:31:35 +0100 Subject: Added keys file --- jl_keys.yaml | 38 ++++++++++++++++++++++++++++++++++++++ 1 file changed, 38 insertions(+) create mode 100644 jl_keys.yaml diff --git a/jl_keys.yaml b/jl_keys.yaml new file mode 100644 index 0000000..22f26ae --- /dev/null +++ b/jl_keys.yaml @@ -0,0 +1,38 @@ +[ + "joelib2.feature.types.FractionRotatableBonds", + "joelib2.feature.types.GeometricalDiameter", + "joelib2.feature.types.GeometricalRadius", + "joelib2.feature.types.GeometricalShapeCoefficient", + "joelib2.feature.types.GraphShapeCoefficient", + "joelib2.feature.types.KierShape1", + "joelib2.feature.types.KierShape2", + "joelib2.feature.types.KierShape3", + "joelib2.feature.types.LogP", + "joelib2.feature.types.MolarRefractivity", + "joelib2.feature.types.MolecularWeight", + "joelib2.feature.types.PolarSurfaceArea", + "joelib2.feature.types.FractionRotatableBonds", + "joelib2.feature.types.RotatableBonds", + "joelib2.feature.types.TopologicalDiameter", + "joelib2.feature.types.TopologicalRadius", + "joelib2.feature.types.ZagrebIndex1", + "joelib2.feature.types.count.AcidicGroups", + "joelib2.feature.types.count.AliphaticOHGroups", + "joelib2.feature.types.count.AromaticBonds", + "joelib2.feature.types.count.AromaticOHGroups", + "joelib2.feature.types.count.BasicGroups", + "joelib2.feature.types.count.HBA1", + "joelib2.feature.types.count.HBA2", + "joelib2.feature.types.count.HBD1", + "joelib2.feature.types.count.HBD2", + "joelib2.feature.types.count.HeavyBonds", + "joelib2.feature.types.count.HeteroCycles", + "joelib2.feature.types.count.HydrophobicGroups", + "joelib2.feature.types.count.NO2Groups", + "joelib2.feature.types.count.NumberOfAtoms", + "joelib2.feature.types.count.NumberOfBonds", + "joelib2.feature.types.count.NumberOfHal", + "joelib2.feature.types.count.OSOGroups", + "joelib2.feature.types.count.SO2Groups", + "joelib2.feature.types.count.OSOGroups" +] -- cgit v1.2.3