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"Cheminformatics Meets Molecular Mechanics: A Combined Application of ..."
Jui-Hua Hsieh et al. (2012)
- 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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