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RDKit
Open-source cheminformatics and machine learning.
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Files | |
file | ConnectivityDescriptors.h [code] |
Use MolDescriptors.h in client code. | |
file | Crippen.h [code] |
Use MolDescriptors.h in client code. | |
file | Lipinski.h [code] |
Contains Lipinski and Lipinski-like descriptors. Use MolDescriptors.h in client code. | |
file | MolDescriptors.h [code] |
file | MolSurf.h [code] |
Use MolDescriptors.h in client code. | |
file | MQN.h [code] |
Use MolDescriptors.h in client code. | |