Wed, 05 Jun 2024 07:03:46 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/share/licenses/python3-cclib/LICENSE1.49 KB
/usr/share/licenses/python3-cclib0.00 B
/usr/share/doc/python3-cclib/THANKS2.22 KB
/usr/share/doc/python3-cclib/CHANGELOG23.48 KB
/usr/share/doc/python3-cclib/ANNOUNCE2.32 KB
/usr/share/doc/python3-cclib0.00 B
/usr/lib/python3.12/site-packages/cclib/scripts/cda.py1.94 KB
/usr/lib/python3.12/site-packages/cclib/scripts/ccwrite.py3.48 KB
/usr/lib/python3.12/site-packages/cclib/scripts/ccget.py7.18 KB
/usr/lib/python3.12/site-packages/cclib/scripts/ccframe.py2.84 KB
/usr/lib/python3.12/site-packages/cclib/scripts/__pycache__/cda.cpython-312.pyc3.09 KB
/usr/lib/python3.12/site-packages/cclib/scripts/__pycache__/cda.cpython-312.opt-1.pyc3.09 KB
/usr/lib/python3.12/site-packages/cclib/scripts/__pycache__/ccwrite.cpython-312.pyc3.86 KB
/usr/lib/python3.12/site-packages/cclib/scripts/__pycache__/ccwrite.cpython-312.opt-1.pyc3.86 KB
/usr/lib/python3.12/site-packages/cclib/scripts/__pycache__/ccget.cpython-312.pyc6.54 KB
/usr/lib/python3.12/site-packages/cclib/scripts/__pycache__/ccget.cpython-312.opt-1.pyc6.54 KB
/usr/lib/python3.12/site-packages/cclib/scripts/__pycache__/ccframe.cpython-312.pyc3.42 KB
/usr/lib/python3.12/site-packages/cclib/scripts/__pycache__/ccframe.cpython-312.opt-1.pyc3.42 KB
/usr/lib/python3.12/site-packages/cclib/scripts/__pycache__/__init__.cpython-312.pyc249.00 B
/usr/lib/python3.12/site-packages/cclib/scripts/__pycache__/__init__.cpython-312.opt-1.pyc249.00 B
/usr/lib/python3.12/site-packages/cclib/scripts/__pycache__0.00 B
/usr/lib/python3.12/site-packages/cclib/scripts/__init__.py258.00 B
/usr/lib/python3.12/site-packages/cclib/scripts0.00 B
/usr/lib/python3.12/site-packages/cclib/progress/textprogress.py1.28 KB
/usr/lib/python3.12/site-packages/cclib/progress/qt4progress.py1013.00 B
/usr/lib/python3.12/site-packages/cclib/progress/__pycache__/textprogress.cpython-312.pyc2.09 KB
/usr/lib/python3.12/site-packages/cclib/progress/__pycache__/textprogress.cpython-312.opt-1.pyc2.09 KB
/usr/lib/python3.12/site-packages/cclib/progress/__pycache__/qt4progress.cpython-312.pyc1.76 KB
/usr/lib/python3.12/site-packages/cclib/progress/__pycache__/qt4progress.cpython-312.opt-1.pyc1.76 KB
/usr/lib/python3.12/site-packages/cclib/progress/__pycache__/__init__.cpython-312.pyc427.00 B
/usr/lib/python3.12/site-packages/cclib/progress/__pycache__/__init__.cpython-312.opt-1.pyc427.00 B
/usr/lib/python3.12/site-packages/cclib/progress/__pycache__0.00 B
/usr/lib/python3.12/site-packages/cclib/progress/__init__.py360.00 B
/usr/lib/python3.12/site-packages/cclib/progress0.00 B
/usr/lib/python3.12/site-packages/cclib/parser/utils.py8.50 KB
/usr/lib/python3.12/site-packages/cclib/parser/turbomoleparser.py84.26 KB
/usr/lib/python3.12/site-packages/cclib/parser/qchemparser.py80.44 KB
/usr/lib/python3.12/site-packages/cclib/parser/psi4parser.py52.76 KB
/usr/lib/python3.12/site-packages/cclib/parser/psi3parser.py13.59 KB
/usr/lib/python3.12/site-packages/cclib/parser/orcaparser.py97.97 KB
/usr/lib/python3.12/site-packages/cclib/parser/nwchemparser.py62.79 KB
/usr/lib/python3.12/site-packages/cclib/parser/mopacparser.py9.69 KB
/usr/lib/python3.12/site-packages/cclib/parser/molproparser.py42.69 KB
/usr/lib/python3.12/site-packages/cclib/parser/molcasparser.py47.17 KB
/usr/lib/python3.12/site-packages/cclib/parser/logfileparser.py20.36 KB
/usr/lib/python3.12/site-packages/cclib/parser/jaguarparser.py31.46 KB
/usr/lib/python3.12/site-packages/cclib/parser/gaussianparser.py104.79 KB
/usr/lib/python3.12/site-packages/cclib/parser/gamessukparser.py30.73 KB
/usr/lib/python3.12/site-packages/cclib/parser/gamessparser.py72.35 KB
/usr/lib/python3.12/site-packages/cclib/parser/fchkparser.py13.06 KB
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