"Cheminformatics Meets Molecular Mechanics: A Combined Application of ..."

Jui-Hua Hsieh et al. (2012)

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DOI: 10.1021/CI2002507

access: closed

type: Journal Article

metadata version: 2020-03-06

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Jui-Hua Hsieh, Shuangye Yin, Xiang S. Wang, Shubin Liu, Nikolay V. Dokholyan, Alexander Tropsha:
Cheminformatics Meets Molecular Mechanics: A Combined Application of Knowledge-Based Pose Scoring and Physical Force Field-Based Hit Scoring Functions Improves the Accuracy of Structure-Based Virtual Screening. J. Chem. Inf. Model. 52(1): 16-28 (2012)

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