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Accelerating QM/MM free energy calculations: representing the surroundings by an updated mean charge distribution |
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| Authors: | Rosta Edina Haranczyk Maciej Chu Zhen T Warshel Arieh |
| Institution: | Department of Chemistry, University of Southern California, 418 SGM Building, 3620 McClintock Avenue, Los Angeles, California 90089-1062, USA. |
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| 本文献已被 PubMed 等数据库收录！ | |