Corpus ID: 51857640

Fingerprint and descriptor generation-GenerateMD

@inproceedings{2018FingerprintAD,
  title={Fingerprint and descriptor generation-GenerateMD},
  author={},
  year={2018}
}
  • Published 2018
  • Introduction Molecular descriptors Molecular descriptor sets Generating descriptors Storing descriptors in database Usage Commands Options Input Output Descriptors Chemical fingerprint Reaction fingerprint PF: 2-dimensional pharmacophore fingerprint Fuzzy pharmacophore fingerprint Burden eigenvalue descriptors Scalar descriptors File output Database output Statistics Configuration Files Chemical fingerprints Example 2-d pharmacophore fingerprints Example BCUT descriptors Example Examples… CONTINUE READING

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