Fiction, especially science fiction, is full of magical force fields. In 2006, scientists at the University of Florida were researching a particularly strong forcefield on a molecular level.
In this paper molecular dynamics (MD) simulation was applied to validate COMPASS forcefield for HMX.
首先通过分子动力学(MD)模拟考察了COMPASS力场对HMX的适用性。
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The ABEEM/MM forcefield for protein model is the fluctuating charge model for protein combined atom-bond electronegativity equalization method (ABEEM) and molecular methanics(MM).