protein node features . | ligand node features . | edge features . |
---|---|---|
atom type(7) | atom type(7) | bond type(7) |
atom degree(10) | atom degree(10) | distance(1) |
implicit valence(6) | implicit valence(6) | |
neighboring hydrogen(6) | neighboring hydrogen(6) | |
hybridization(9) | hybridization(9) | |
amino acid type(22) | formal charge(22) | |
atom name(37) | ring size(12) | |
aromatic(2) |
protein node features . | ligand node features . | edge features . |
---|---|---|
atom type(7) | atom type(7) | bond type(7) |
atom degree(10) | atom degree(10) | distance(1) |
implicit valence(6) | implicit valence(6) | |
neighboring hydrogen(6) | neighboring hydrogen(6) | |
hybridization(9) | hybridization(9) | |
amino acid type(22) | formal charge(22) | |
atom name(37) | ring size(12) | |
aromatic(2) |
protein node features . | ligand node features . | edge features . |
---|---|---|
atom type(7) | atom type(7) | bond type(7) |
atom degree(10) | atom degree(10) | distance(1) |
implicit valence(6) | implicit valence(6) | |
neighboring hydrogen(6) | neighboring hydrogen(6) | |
hybridization(9) | hybridization(9) | |
amino acid type(22) | formal charge(22) | |
atom name(37) | ring size(12) | |
aromatic(2) |
protein node features . | ligand node features . | edge features . |
---|---|---|
atom type(7) | atom type(7) | bond type(7) |
atom degree(10) | atom degree(10) | distance(1) |
implicit valence(6) | implicit valence(6) | |
neighboring hydrogen(6) | neighboring hydrogen(6) | |
hybridization(9) | hybridization(9) | |
amino acid type(22) | formal charge(22) | |
atom name(37) | ring size(12) | |
aromatic(2) |
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