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Package Details: python-mdtraj 1.9.7-1
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Git Clone URL: | https://aur.archlinux.org/python-mdtraj.git (read-only, click to copy) |
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Package Base: | python-mdtraj |
Description: | A modern, open library for the analysis of molecular dynamics trajectories |
Upstream URL: | http://mdtraj.org/ |
Licenses: | LGPL |
Submitter: | hseara |
Maintainer: | hseara |
Last Packager: | hseara |
Votes: | 4 |
Popularity: | 0.027771 |
First Submitted: | 2014-10-01 14:14 (UTC) |
Last Updated: | 2022-01-06 12:01 (UTC) |
Dependencies (9)
- python-numpy (python-numpy-git, python-numpy1.22, python-numpy-openblas, python-numpy-flame, python-numpy-mkl-bin, python-numpy-mkl)
- cython (cython-git, cython3) (make)
- python-setuptools (make)
- python-networkx (python-networkx-git) (optional) – Required for some of the functions
- python-nose (optional) – To run tests.
- python-pandas (optional) – Some functionality, including mol2 parsing, requires pandas.
- python-pytables (optional) – Working with HDF5 formatted trajectories requires the PyTables package.
- python-scipy (python-scipy-git, python-scipy-mkl-bin, python-scipy-mkl) (optional) – For loading and saving AMBER netcdf formatted trajectories.
- python-scripttest (optional) – To run some of the tests with nose "nosetest -v mdtraj".
Latest Comments
FoPref commented on 2021-01-20 17:08 (UTC) (edited on 2021-01-20 17:08 (UTC) by FoPref)
The package has a hard build dependency (introduced by the PKGBUILD) on gcc-8 which is missing from makedepends
burning_daylight commented on 2020-02-06 16:52 (UTC)
Installation fails with: