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Package Details: python-cclib-git 1.6.3.r2939.8ecf965c-2
| Git Clone URL: | https://aur.archlinux.org/python-cclib-git.git (read-only, click to copy) |
|---|---|
| Package Base: | python-cclib-git |
| Description: | A library for parsing and interpreting the results of computational chemistry packages. (git version) |
| Upstream URL: | http://cclib.github.io |
| Licenses: | |
| Conflicts: | |
| Provides: | |
| Submitter: | berquist |
| Maintainer: | berquist |
| Last Packager: | berquist |
| Votes: | 0 |
| Popularity: | 0.000000 |
| First Submitted: | 2015-06-17 15:13 |
| Last Updated: | 2019-12-24 13:36 |
Dependencies (9)
- python-numpy (python-numpy-openblas, python-numpy-mkl, python-numpy-mkl-bin)
- python-packaging
- python-periodictable
- git (git-git) (make)
- python-setuptools (make)
- python-biopython (optional) – for generating `BioPython.Atom`s of parsed results
- python-openbabel (optional) – for generating `OBMol`s of results
- python-pandas (optional) – for generating DataFrames of parsed results
- python-scipy (python-scipy-mkl-bin, python-scipy-mkl, python-scipy-openblas) (optional) – for calculating properties of nuclear configurations
Required by (2)
- avogadrolibs-git (requires python-cclib)
- gausssum (requires python-cclib)