Pattern-free generation and quantum mechanical scoring of...

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Journal of Computer-Aided Molecular Design 2020 / 08

Pattern-free generation and quantum mechanical scoring of ring-chain tautomers

Levine, Daniel S., Watson, Mark A., Jacobson, Leif D., Dickerson, Claire E., Yu, Haoyu S., Bochevarov, Art D.
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Journal:
Journal of Computer-Aided Molecular Design
DOI:
10.1007/s10822-020-00334-w
Date:
August, 2020
File:
PDF, 1.34 MB
2020
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