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"Virtual-system-coupled adaptive umbrella sampling to compute free-energy ..."
Junichi Higo et al. (2015)
- Junichi Higo, Bhaskar Dasgupta, Tadaaki Mashimo, Kota Kasahara, Yoshifumi Fukunishi, Haruki Nakamura:
Virtual-system-coupled adaptive umbrella sampling to compute free-energy landscape for flexible molecular docking. J. Comput. Chem. 36(20): 1489-1501 (2015)
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