"Conformational Free Energy Modeling of Druglike Molecules by Metadynamics ..."

Vojtech Spiwok et al. (2012)

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DOI: 10.1021/CI200623N

access: closed

type: Journal Article

metadata version: 2021-10-14

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Vojtech Spiwok, Katarína Hlat-Glembová, Igor Tvaroska, Blanka Králová:
Conformational Free Energy Modeling of Druglike Molecules by Metadynamics in the WHIM Space. J. Chem. Inf. Model. 52(3): 804-813 (2012)

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