Commit d77ccf9b authored by Bharath Ramsundar's avatar Bharath Ramsundar Committed by GitHub
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Merge pull request #440 from lilleswing/RdkitGridFeaturizer-cr2

Rdkit Grid Featurizer For Pdbbind benchmark
parents 7fe2b751 6b33108d
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Original line number Diff line number Diff line
@@ -18,6 +18,7 @@ from deepchem.feat.basic import RDKitDescriptors
from deepchem.feat.coulomb_matrices import CoulombMatrix
from deepchem.feat.coulomb_matrices import CoulombMatrixEig
from deepchem.feat.grid_featurizer import GridFeaturizer
from deepchem.feat.rdkit_grid_featurizer import RdkitGridFeaturizer
from deepchem.feat.nnscore_utils import hydrogenate_and_compute_partial_charges
from deepchem.feat.binding_pocket_features import BindingPocketFeaturizer
from deepchem.feat.one_hot import OneHotFeaturizer
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