mdtraj 1.9.7-5build1 source package in Ubuntu
Changelog
mdtraj (1.9.7-5build1) lunar; urgency=medium * No-change rebuild with Python 3.11 only -- Graham Inggs <email address hidden> Wed, 15 Mar 2023 06:33:28 +0000
Upload details
- Uploaded by:
- Graham Inggs
- Uploaded to:
- Lunar
- Original maintainer:
- Debichem Team
- Architectures:
- any-amd64 arm64 i386 all
- Section:
- misc
- Urgency:
- Medium Urgency
See full publishing history Publishing
Series | Published | Component | Section | |
---|---|---|---|---|
Lunar | release | universe | misc |
Downloads
File | Size | SHA-256 Checksum |
---|---|---|
mdtraj_1.9.7.orig.tar.gz | 20.7 MiB | 5c84c41e3a01e6512ac7077d153c8cb1ee01d82140ca532507c50c87650937e6 |
mdtraj_1.9.7-5build1.debian.tar.xz | 292.6 KiB | fcfe416c6cbbbde621b38d97979f1e37666b54823e025238c350b3e2e31c94dd |
mdtraj_1.9.7-5build1.dsc | 2.6 KiB | 006705d204b83a6980b0a4ea68dc77df8544ba49e20e1767623b5af4be2c2bf1 |
Available diffs
- diff from 1.9.7-5 (in Debian) to 1.9.7-5build1 (330 bytes)
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: debug symbols for python3-mdtraj