MDTraj: a python library for loading, saving, and manipulating molecular dynamics trajectories.

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  • License: GNU General Public License v3 or later (GPLv3+) (GPLv3+)
  • Author: Robert McGibbon
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MDTraj provides an easy to use python interface for manipulating MD trajectories. It supports the reading and writing of molecular dynamics trajectories in a variety of formats, including full support for PDB, DCD, XTC, TRR, binpos, AMBER NetCDF, AMBER mdcrd and MDTraj HDF5. The package also provides a command line script for converting trajectories between supported formats.

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  • License: GNU General Public License v3 or later (GPLv3+) (GPLv3+)
  • Author: Robert McGibbon
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1.11.1.post1

1.11.1

1.11.0

1.10.3

1.10.2

1.10.1

1.10.0

1.10.0rc2 pre-release

1.10.0rc1 pre-release

1.9.9

1.9.8

1.9.7

1.9.6

1.9.5

1.9.4

1.9.3

1.9.2

1.9.1

1.8.0

1.7.2

1.6.1

1.6.0

1.5.1

1.5.0

1.4.2

1.4.1

1.4.0

1.3.0

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1.0.0

0.9.0

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0.7.0

0.6.1

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0.5.1

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0.4.3

0.4.1

0.4.0

0.3.1

0.3

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