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Special Issue on Free Energy.
McCammon JA, Roux B, Voth G, Yang W. McCammon JA, et al. Among authors: yang w. J Chem Theory Comput. 2014 Jul 8;10(7):2631. doi: 10.1021/ct500366u. J Chem Theory Comput. 2014. PMID: 26586502 No abstract available.
Simultaneous escaping of explicit and hidden free energy barriers: application of the orthogonal space random walk strategy in generalized ensemble based conformational sampling.
Zheng L, Chen M, Yang W. Zheng L, et al. Among authors: yang w. J Chem Phys. 2009 Jun 21;130(23):234105. doi: 10.1063/1.3153841. J Chem Phys. 2009. PMID: 19548709
To overcome this problem in equilibrium conformational sampling, we adopted the orthogonal space random walk (OSRW) strategy, which was originally developed in the context of free energy simulation [L. Zheng, M. Chen, and W. Yang, Proc. Natl. Acad. Sci. U.S.A. 105, …
To overcome this problem in equilibrium conformational sampling, we adopted the orthogonal space random walk (OSRW) strategy, which was orig …
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