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MDTraj

Read, write and analyze MD trajectories with only a few lines of Python code.

homepage: http://mdtraj.org/1.9.0/

version versionsuffix toolchain
1.9.1 -Python-3.6.3 intel/2017b
1.9.2 -Python-3.6.6 intel/2018b
1.9.3 -Python-3.7.4 foss/2019b
1.9.3 -Python-3.7.4 intel/2019b
1.9.4 -Python-3.8.2 foss/2020a
1.9.4 -Python-3.8.2 intel/2020a
1.9.5 foss/2020b
1.9.5 fosscuda/2020b
1.9.5 intel/2020b
1.9.7 foss/2021a
1.9.7 foss/2021b
1.9.7 foss/2022a
1.9.7 intel/2021b
1.9.7 intel/2022a
1.9.9 gfbf/2023a

(quick links: (all) - 0 - a - b - c - d - e - f - g - h - i - j - k - l - m - n - o - p - q - r - s - t - u - v - w - x - y - z)