Enhanced Sampling in Free Energy Calculations: Combining SGLD with the Bennett’s Acceptance Ratio and Enveloping Distribution Sampling Methods

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چکیده

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ژورنال

عنوان ژورنال: Journal of Chemical Theory and Computation

سال: 2012

ISSN: 1549-9618,1549-9626

DOI: 10.1021/ct300116r