Wed, 05 Jun 2024 09:34:28 UTC | login

Information for RPM python3-cclib-1.7.1-7.20220618git8e6892a5.fc40.noarch.rpm

ID1217578
Namepython3-cclib
Version1.7.1
Release7.20220618git8e6892a5.fc40
Epoch
Archnoarch
SummaryParsers for output files of computational chemistry packages
Description cclib is a Python library that provides parsers for output files of computational chemistry packages. It also provides a platform for computational chemists to implement algorithms in a platform-independent way. The goals of cclib are centered around the reuse of data obtained from these programs and contained in output files, specifically: - extract (parse) data from the output files generated by multiple programs - provide a consistent interface to the results of computational chemistry calculations, particularly those results that are useful for algorithms or visualization - facilitate the implementation of algorithms that are not specific to a particular computational chemistry package - to maximize interoperability with other open source computational chemistry and cheminformatic software libraries.
Build Time2024-01-26 02:28:02 GMT
Size576.97 KB
e127a8c87ecaf7fbf081b0b9c0a2cc66
LicenseBSD and LGPLv2+
Provides
python-cclib = 1.7.1-7.20220618git8e6892a5.fc40
python3-cclib = 1.7.1-7.20220618git8e6892a5.fc40
python3.12-cclib = 1.7.1-7.20220618git8e6892a5.fc40
python3.12dist(cclib) = 1.7.1
python3dist(cclib) = 1.7.1
Obsoletes No Obsoletes
Conflicts No Conflicts
Requires
/usr/bin/python3
python(abi) = 3.12
python3.12dist(numpy)
python3.12dist(packaging) >= 19
python3.12dist(periodictable)
python3.12dist(scipy) >= 1.2
rpmlib(CompressedFileNames) <= 3.0.4-1
rpmlib(FileDigests) <= 4.6.0-1
rpmlib(PartialHardlinkSets) <= 4.0.4-1
rpmlib(PayloadFilesHavePrefix) <= 4.0-1
rpmlib(PayloadIsZstd) <= 5.4.18-1
Recommends No Recommends
Suggests No Suggests
Supplements No Supplements
Enhances No Enhances
Files
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/usr/lib/python3.12/site-packages/cclib/io/__pycache__/cjsonreader.cpython-312.pyc2.28 KB
/usr/lib/python3.12/site-packages/cclib/io/__pycache__/cjsonwriter.cpython-312.opt-1.pyc12.13 KB
/usr/lib/python3.12/site-packages/cclib/io/__pycache__/cjsonwriter.cpython-312.pyc12.13 KB
/usr/lib/python3.12/site-packages/cclib/io/__pycache__/cmlwriter.cpython-312.opt-1.pyc4.83 KB
/usr/lib/python3.12/site-packages/cclib/io/__pycache__/cmlwriter.cpython-312.pyc4.83 KB
/usr/lib/python3.12/site-packages/cclib/io/__pycache__/filereader.cpython-312.opt-1.pyc1.55 KB
/usr/lib/python3.12/site-packages/cclib/io/__pycache__/filereader.cpython-312.pyc1.55 KB
/usr/lib/python3.12/site-packages/cclib/io/__pycache__/filewriter.cpython-312.opt-1.pyc6.42 KB
/usr/lib/python3.12/site-packages/cclib/io/__pycache__/filewriter.cpython-312.pyc6.42 KB
/usr/lib/python3.12/site-packages/cclib/io/__pycache__/moldenwriter.cpython-312.opt-1.pyc12.70 KB
/usr/lib/python3.12/site-packages/cclib/io/__pycache__/moldenwriter.cpython-312.pyc12.70 KB
/usr/lib/python3.12/site-packages/cclib/io/__pycache__/wfxwriter.cpython-312.opt-1.pyc26.07 KB
/usr/lib/python3.12/site-packages/cclib/io/__pycache__/wfxwriter.cpython-312.pyc26.07 KB
/usr/lib/python3.12/site-packages/cclib/io/__pycache__/xyzreader.cpython-312.opt-1.pyc2.66 KB
/usr/lib/python3.12/site-packages/cclib/io/__pycache__/xyzreader.cpython-312.pyc2.86 KB
/usr/lib/python3.12/site-packages/cclib/io/__pycache__/xyzwriter.cpython-312.opt-1.pyc4.14 KB
/usr/lib/python3.12/site-packages/cclib/io/__pycache__/xyzwriter.cpython-312.pyc4.14 KB
/usr/lib/python3.12/site-packages/cclib/io/ccio.py19.48 KB
/usr/lib/python3.12/site-packages/cclib/io/cjsonreader.py1.85 KB
/usr/lib/python3.12/site-packages/cclib/io/cjsonwriter.py9.49 KB
/usr/lib/python3.12/site-packages/cclib/io/cmlwriter.py3.45 KB
/usr/lib/python3.12/site-packages/cclib/io/filereader.py1.11 KB
/usr/lib/python3.12/site-packages/cclib/io/filewriter.py5.06 KB
/usr/lib/python3.12/site-packages/cclib/io/moldenwriter.py10.23 KB
/usr/lib/python3.12/site-packages/cclib/io/wfxwriter.py18.82 KB
/usr/lib/python3.12/site-packages/cclib/io/xyzreader.py2.38 KB
/usr/lib/python3.12/site-packages/cclib/io/xyzwriter.py3.97 KB
/usr/lib/python3.12/site-packages/cclib/method0.00 B
/usr/lib/python3.12/site-packages/cclib/method/__init__.py988.00 B
/usr/lib/python3.12/site-packages/cclib/method/__pycache__0.00 B
/usr/lib/python3.12/site-packages/cclib/method/__pycache__/__init__.cpython-312.opt-1.pyc1.15 KB
/usr/lib/python3.12/site-packages/cclib/method/__pycache__/__init__.cpython-312.pyc1.15 KB
/usr/lib/python3.12/site-packages/cclib/method/__pycache__/bader.cpython-312.opt-1.pyc9.39 KB
/usr/lib/python3.12/site-packages/cclib/method/__pycache__/bader.cpython-312.pyc9.89 KB
/usr/lib/python3.12/site-packages/cclib/method/__pycache__/bickelhaupt.cpython-312.opt-1.pyc6.87 KB
/usr/lib/python3.12/site-packages/cclib/method/__pycache__/bickelhaupt.cpython-312.pyc6.87 KB
/usr/lib/python3.12/site-packages/cclib/method/__pycache__/calculationmethod.cpython-312.opt-1.pyc3.04 KB
/usr/lib/python3.12/site-packages/cclib/method/__pycache__/calculationmethod.cpython-312.pyc3.04 KB
/usr/lib/python3.12/site-packages/cclib/method/__pycache__/cda.cpython-312.opt-1.pyc5.83 KB
/usr/lib/python3.12/site-packages/cclib/method/__pycache__/cda.cpython-312.pyc5.83 KB
/usr/lib/python3.12/site-packages/cclib/method/__pycache__/cspa.cpython-312.opt-1.pyc5.09 KB
/usr/lib/python3.12/site-packages/cclib/method/__pycache__/cspa.cpython-312.pyc5.09 KB
/usr/lib/python3.12/site-packages/cclib/method/__pycache__/ddec.cpython-312.opt-1.pyc41.19 KB
/usr/lib/python3.12/site-packages/cclib/method/__pycache__/ddec.cpython-312.pyc41.19 KB
/usr/lib/python3.12/site-packages/cclib/method/__pycache__/density.cpython-312.opt-1.pyc3.98 KB
/usr/lib/python3.12/site-packages/cclib/method/__pycache__/density.cpython-312.pyc3.98 KB
/usr/lib/python3.12/site-packages/cclib/method/__pycache__/electrons.cpython-312.opt-1.pyc2.27 KB
/usr/lib/python3.12/site-packages/cclib/method/__pycache__/electrons.cpython-312.pyc2.27 KB
/usr/lib/python3.12/site-packages/cclib/method/__pycache__/fragments.cpython-312.opt-1.pyc7.13 KB
/usr/lib/python3.12/site-packages/cclib/method/__pycache__/fragments.cpython-312.pyc7.13 KB
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