RDKit
Open-source cheminformatics and machine learning.
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Files | |
base64.h | |
Functionality for base64 encoding/decoding. | |
BitOps.h | |
Contains general bit-comparison and similarity operations. | |
BitVect.h | |
BitVects.h | |
Pulls in all the BitVect classes. | |
BitVectUtils.h | |
DatastructsException.h | |
DatastructsStreamOps.h | |
DiscreteDistMat.h | |
DiscreteValueVect.h | |
ExplicitBitVect.h | |
FPBReader.h | |
contains a simple class for reading and searching FPB files | |
MultiFPBReader.h | |
contains a class for reading and searching collections of FPB files | |
SparseBitVect.h | |
SparseIntVect.h | |