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| The physical origin of hydrophobic effects 期刊论文
CHEMICAL PHYSICS LETTERS, 2017
Sun, Qiang
  收藏 | 浏览/下载：8/0 | 提交时间：2017/12/03
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| Simultaneous Optimization of Biomolecular Energy Functions on Features from Small Molecules and Macromolecules 期刊论文
JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2016
Park, Hahnbeom; Bradley, Philip; Greisen, Per, Jr.; Liu, Yuan; Mulligan, Vikram Khipple; Kim, David E.; Baker, David; DiMaio, Frank
收藏 | 浏览/下载：5/0 | 提交时间：2017/12/03
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| QM/MM studies of solution reactions, a reaction coordinate-free approach 其他
2014-01-01
Yi Qin Gao
收藏 | 浏览/下载：3/0 | 提交时间：2017/12/03
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| Parameterization of PACE Force Field for Membrane Environment and Simulation of Helical Peptides and Helix-Helix Association 期刊论文
journal of chemical theory and computation, 2012
Wan, Cheuk-Kin; Han, Wei; Wu, Yun-Dong
收藏 | 浏览/下载：7/0 | 提交时间：2015/11/12
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| Folding simulation of polypeptides, free energy landscape calculation and effects of solvation 期刊论文
abstracts of papers of the american chemical society, 2012
Gao, Yi Qin
收藏 | 浏览/下载：1/0 | 提交时间：2015/11/13 |
| SDOCK: A Global Protein-Protein Docking Program Using Stepwise Force-Field Potentials 期刊论文
journal of computational chemistry, 2011
Zhang, Changsheng; Lai, Luhua
收藏 | 浏览/下载：2/0 | 提交时间：2015/11/10
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| SOLVATION ENERGY OF NONEQUILIBRIUM POLARIZATION: OLD QUESTION, NEW ANSWER 期刊论文
journal of theoretical computational chemistry, 2010
Li, Xiang-Yuan; He, Fu-Cheng; Fu, Ke-Xiang; Liu, Wenjian
收藏 | 浏览/下载：3/0 | 提交时间：2015/11/16
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| Coorperativity between Metals, Ligands and Solvent: a DFT Study on the Mechanism of a Dizinc Complex-Mediated Phosphodiester Cleavage 期刊论文
物理化学学报, 2010
Fan Yu-Bo; Gao Yi-Qin
收藏 | 浏览/下载：5/0 | 提交时间：2015/11/16
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| Temperature Dependence of Hydrogen-Bond Stability in beta-Hairpin Structures 期刊论文
journal of chemical theory and computation, 2010
Shao, Qiang; Gao, Yi Qin
收藏 | 浏览/下载：4/0 | 提交时间：2015/11/10
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| Parameterization and Validation of Solvation Corrected Atomic Radii 期刊论文
journal of physical chemistry a, 2009
Zuo, Chun-Shan; Wiest, Olaf; Wu, Yun-Dong
收藏 | 浏览/下载：3/0 | 提交时间：2015/11/10
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