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Top 2.4% dependent packages on conda-forge.org
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conda-forge.org : mdtraj
MDTraj is a python library that allows users to manipulate molecular dynamics (MD) trajectories and perform a variety of analyses, including fast RMSD, solvent accessible surface area, hydrogen bonding, etc. A highlight of MDTraj is the wide variety of molecular dynamics trajectory file formats which are supported, including RCSB pdb, GROMACS xtc, tng, and trr, CHARMM / NAMD dcd, AMBER binpos, AMBER NetCDF, AMBER mdcrd, TINKER arc and MDTraj HDF5.
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purl: pkg:conda/mdtraj
Keywords: dihedral-angles, mdtraj, molecular-dynamics, molecular-dynamics-trajectories, pdb, pdb-files, python, rmsd
License: SSPL-1.0
Latest release: over 1 year ago
First release: over 1 year ago
Dependent packages: 28
Dependent repositories: 70
Stars: 433 on GitHub
Forks: 247 on GitHub
See more repository details: repos.ecosyste.ms
Last synced: 8 days ago