Sampling Enrichment toward Target Structures Using Hybrid Molecular Dynamics-Monte Carlo Simulations.

by Kecheng Yang, Bartosz Różycki, Fengchao Cui, Ce Shi, Wenduo Chen, Yunqi Li
Published 2016-01-01

GPU-Accelerated Molecular Dynamics Simulation to Study Liquid Crystal Phase Transition Using Coarse-Grained Gay-Berne Anisotropic Potential.

by Wenduo Chen, Youliang Zhu, Fengchao Cui, Lunyang Liu, Zhaoyan Sun, Jizhong Chen, Yunqi Li
Published 2016-01-01