Automatic state decomposition of molecular simulation data
收藏资源简介：
A set of algorithms for the construction of master equation / Markov models of molecular dynamics. <br/><br/>This project includes the following software/data packages: <br/> <ul> <li> <a href="https://simtk.org/frs?group_id=237#pack_1392">datasets </a> : Datasets from the paper. </li> <li> <a href="https://simtk.org/frs?group_id=237#pack_1384">decompose-95 </a> : Fortran 95 code for automatic state decomposition. </li> </ul>
一套构建分子动力学中主方程/马尔可夫模型的算法集。该项目包含以下软件/数据包： <br/> <ul> <li><a href="https://simtk.org/frs?group_id=237#pack_1392">数据集</a>：来自论文的数据集。</li> <li><a href="https://simtk.org/frs?group_id=237#pack_1384">分解-95</a>：用于自动状态分解的 Fortran 95 代码。</li> </ul>
