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The extended adaptive biasing force algorithm.An on-the-fly implementation for accurate free-energy
【机 构】
:
Research Center for Analytical Sciences,College of Chemistry,Nankai University,Tianjin 300071,China
【出 处】
:
第四届国际分子模拟大会(The International Conference on Molecular Simula
【发表日期】
:
2016年4期
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