MDAnalysisTests 0.7.5

Company: Naveen Michaud-Agrawal

Date Added: November 07, 2013 | Visits: 215

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MDAnalysis is an object-oriented python toolkit to analyze molecular dynamics trajectories generated by CHARMM, Gromacs, NAMD, LAMMPS, or Amber.<br /><br />It allows one to read molecular dynamics trajectories and access the atomic coordinates through numpy arrays. This provides a flexible and relatively fast framework for complex analysis tasks. In addition, CHARMM-style atom selection commands are implemented. Trajectories can also be manipulated (for instance, fit to a reference structure) and written out.

Requirements: No special requirements

Platforms: *nix, Linux

Keyword: Addition, Analysis, Charmmstyle, Complex, Flexible, Framework, Selection, Tasks

Users rating: 0/10

License: Shareware

Size: 18.25 MB

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