Accurate and Efficient Treatment of Continuous Solute Charge Density in the Mean-Field QM/MM Free Energy Calculation
Author:
Affiliation:
1. Department of Chemistry, Graduate School of Science, Kyoto University, Kyoto 606-8502, Japan
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry,Computer Science Applications
Link
https://pubs.acs.org/doi/pdf/10.1021/ct300831t
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