mdtraj 1.9.7-4 source package in Ubuntu
Changelog
mdtraj (1.9.7-4) unstable; urgency=medium * debian/tests: add Restrictions: needs-internet (test_examples.py pulls a random PDB sample file from www.rcsb.org) * debian patch test_increase_timeout.patch increases TIMEOUT to 180 sec in test_examples.py to allow for poor internet connections. Closes: #1009079. * Standards-Version: 4.6.1 -- Drew Parsons <email address hidden> Wed, 01 Jun 2022 18:02:27 +0200
Upload details
- Uploaded by:
- Debichem Team
- Uploaded to:
- Sid
- Original maintainer:
- Debichem Team
- Architectures:
- any-amd64 arm64 i386 all
- Section:
- misc
- Urgency:
- Medium Urgency
See full publishing history Publishing
Series | Published | Component | Section |
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Downloads
File | Size | SHA-256 Checksum |
---|---|---|
mdtraj_1.9.7-4.dsc | 2.5 KiB | c0532349b037525293715448027ef200b15a3f6e1eb633478efeeff125c00f07 |
mdtraj_1.9.7.orig.tar.gz | 20.7 MiB | 5c84c41e3a01e6512ac7077d153c8cb1ee01d82140ca532507c50c87650937e6 |
mdtraj_1.9.7-4.debian.tar.xz | 292.3 KiB | 1c1d4e8c1cb12f9d39ad26f092fd3130b7f8fe16cd8b816344a7e7699613c5df |
Available diffs
- diff from 1.9.7-3.1 to 1.9.7-4 (1.0 KiB)
No changes file available.
Binary packages built by this source
- python-mdtraj-doc: Read, write and analyze MD trajectories in Python (documentation)
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.
.
This is the documentation package for mdtraj.
- python3-mdtraj: 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.
- python3-mdtraj-dbgsym: No summary available for python3-mdtraj-dbgsym in ubuntu kinetic.
No description available for python3-
mdtraj- dbgsym in ubuntu kinetic.