RDKit
Open-source cheminformatics and machine learning.
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UFFOptimizeMolecule() :
RDKit::UFF
UFFOptimizeMoleculeConfs() :
RDKit::UFF
Union() :
RDKit
uniquifyPaths() :
RDKit::Subgraphs
updateAtomNeighborIndex() :
RDKit::Canon
updateAtomNeighborNumSwaps() :
RDKit::Canon
updateFromSequence() :
RDKit
updateProductsStereochem() :
RDKit
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