Package: python3-mdtraj
Source: mdtraj
Version: 1.11.0-2build1
Architecture: arm64
Maintainer: Ubuntu Developers <ubuntu-devel-discuss@lists.ubuntu.com>
Original-Maintainer: Debichem Team <debichem-devel@lists.alioth.debian.org>
Installed-Size: 4527
Depends: python3 (<< 3.15), python3 (>= 3.14~), python3-numpy (>= 2.0.0~), python3-numpy2-abi0 | python3-numpy-abi9, python3-packaging, python3-pyparsing, python3-scipy, python3:any, libc6 (>= 2.43), libgcc-s1 (>= 3.3.1), libgomp1 (>= 4.9), libstdc++6 (>= 13.1), python3-networkx, python3-pandas, python3-tables
Recommends: python3-gsd, python3-netcdf4
Suggests: python-mdtraj-doc
Section: python
Priority: optional
Homepage: https://mdtraj.org/
Description: Read, write and analyze MD trajectories in Python
 Read, write and analyze MD trajectories with only a few lines of
 Python code.
 .
 MDTraj is a Python library that allows users to manipulate molecular
 dynamics (MD) trajectories. Features include:
  * Wide MD format support, including pdb, xtc, trr, dcd, binpos,
  netcdf, mdcrd, prmtop, and more.
  * Extremely fast RMSD calculations (4x the speed of the original
  Theobald QCP).
  * Extensive analysis functions including those that compute bonds,
  angles, dihedrals, hydrogen bonds, secondary structure, and NMR
  observables.
  * Lightweight, Pythonic API.
 .
 MDTraj includes a command-line application, mdconvert-mdtraj,
 for converting trajectories between formats.
 .
 This package installs the library for Python 3, together with the
 command line utilities mdconvert-mdtraj and mdinspect.
