Metadata-Version: 2.4
Name: mdtraj
Version: 1.11.0
Summary: MDTraj: A modern, open library for the analysis of molecular dynamics trajectories
Home-page: http://mdtraj.org
Download-URL: https://github.com/rmcgibbo/mdtraj/releases/latest
Author: Robert McGibbon
Author-email: rmcgibbo@gmail.com
License: LGPLv2.1+
Platform: Linux
Platform: Mac OS-X
Platform: Unix
Platform: Windows
Classifier: Development Status :: 5 - Production/Stable
Classifier: Intended Audience :: Science/Research
Classifier: Intended Audience :: Developers
Classifier: License :: OSI Approved :: GNU Lesser General Public License v2 or later (LGPLv2+)
Classifier: Programming Language :: C
Classifier: Programming Language :: Python
Classifier: Programming Language :: Python :: 3
Classifier: Topic :: Scientific/Engineering :: Bio-Informatics
Classifier: Topic :: Scientific/Engineering :: Chemistry
Classifier: Operating System :: Microsoft :: Windows
Classifier: Operating System :: POSIX
Classifier: Operating System :: Unix
Classifier: Operating System :: MacOS
Requires-Python: >=3.11
License-File: LICENSE
Requires-Dist: numpy<3,>=1.25.0
Requires-Dist: scipy
Requires-Dist: pyparsing
Requires-Dist: packaging
Provides-Extra: tests
Requires-Dist: pytest; extra == "tests"
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Requires-Dist: pandas; extra == "optional"
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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, and trr, CHARMM / NAMD dcd, AMBER
AMBER NetCDF, AMBER mdcrd, TINKER arc and MDTraj HDF5.
