Beyond Rotatable Bond Counts: Capturing 3D Conformational Flexibility in a Single Descriptor
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- Jerome G. P. Wicker
- Chemical Crystallography, University of Oxford, Oxford OX1 3TA, U.K.
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- Richard I. Cooper
- Chemical Crystallography, University of Oxford, Oxford OX1 3TA, U.K.
収録刊行物
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- Journal of Chemical Information and Modeling
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Journal of Chemical Information and Modeling 56 (12), 2347-2352, 2016-12-06
American Chemical Society (ACS)