"ClassicalGSG: Prediction of logP using classical molecular force fields ..."

Nazanin Donyapour, Matthew J. Hirn, Alex Dickson (2021)

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DOI: 10.1002/JCC.26519

access: closed

type: Journal Article

metadata version: 2021-05-16

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Nazanin Donyapour, Matthew J. Hirn, Alex Dickson:
ClassicalGSG: Prediction of logP using classical molecular force fields and geometric scattering for graphs. J. Comput. Chem. 42(14): 1006-1017 (2021)

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