[ 源代码: cpptraj ]
软件包:cpptraj(5.1.0+dfsg-4 以及其他的)
fast, parallelized molecular dynamics trajectory data analysis
CPPTRAJ is a program designed to process and analyze molecular dynamics trajectories and relevant data sets derived from their analysis. CPPTRAJ supports many popular MD software packages including Amber, CHARMM, Gromacs, and NAMD.
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