Index | index by Group | index by Distribution | index by Vendor | index by creation date | index by Name | Mirrors | Help | Search |
Name: nwchem | Distribution: Fedora Project |
Version: 7.0.2 | Vendor: Fedora Project |
Release: 11.fc37 | Build date: Fri Jul 22 03:18:32 2022 |
Group: Unspecified | Build host: buildvm-x86-15.iad2.fedoraproject.org |
Size: 0 | Source RPM: nwchem-7.0.2-11.fc37.src.rpm |
Packager: Fedora Project | |
Url: https://nwchemgit.github.io/ | |
Summary: Delivering High-Performance Computational Chemistry to Science |
NWChem aims to provide its users with computational chemistry tools that are scalable both in their ability to treat large scientific computational chemistry problems efficiently, and in their use of available parallel computing resources from high-performance parallel supercomputers to conventional workstation clusters. Please cite the following reference when publishing results obtained with NWChem: M. Valiev, E.J. Bylaska, N. Govind, K. Kowalski, T.P. Straatsma, H.J.J. van Dam, D. Wang, J. Nieplocha, E. Apra, T.L. Windus, W.A. de Jong, "NWChem: a comprehensive and scalable open-source solution for large scale molecular simulations" Comput. Phys. Commun. 181, 1477 (2010) There is currently no serial version built.
ECL 2.0
* Fri Jul 22 2022 Fedora Release Engineering <releng@fedoraproject.org> - 7.0.2-11 - Rebuilt for https://fedoraproject.org/wiki/Fedora_37_Mass_Rebuild * Mon Jun 13 2022 Python Maint <python-maint@redhat.com> - 7.0.2-10 - Rebuilt for Python 3.11 * Thu Jan 20 2022 Fedora Release Engineering <releng@fedoraproject.org> - 7.0.2-9 - Rebuilt for https://fedoraproject.org/wiki/Fedora_36_Mass_Rebuild * Thu Jul 22 2021 Fedora Release Engineering <releng@fedoraproject.org> - 7.0.2-8 - Rebuilt for https://fedoraproject.org/wiki/Fedora_35_Mass_Rebuild * Fri Jun 04 2021 Python Maint <python-maint@redhat.com> - 7.0.2-7 - Rebuilt for Python 3.10 * Wed Jan 27 2021 Marcin Dulak <Marcin.Dulak@gmail.com> - 7.0.2-6 - Requires nwchem instead of %{name-common} to handle install dependencies - export FLEXIBLAS=openblas-serial using a wrapper https://bugzilla.redhat.com/show_bug.cgi?id=1920009 * Tue Jan 26 2021 Fedora Release Engineering <releng@fedoraproject.org> - 7.0.2-5 - Rebuilt for https://fedoraproject.org/wiki/Fedora_34_Mass_Rebuild * Tue Nov 24 2020 Marcin Dulak <Marcin.Dulak@gmail.com> - 7.0.2-4 - Patch for Python 3.10 - Compile with USE_NOIO=TRUE https://github.com/nwchemgit/nwchem/issues/272 * Sat Nov 21 2020 Marcin Dulak <Marcin.Dulak@gmail.com> - 7.0.2-3 - Replace OMP_NUM_THREADS=1 with FLEXIBLAS=openblas-serial to restore https://src.fedoraproject.org/rpms/flexiblas/c/4286c061697330a8d30d2cd3a1d20f018da81258 - Replace mentions of the old website with nwchemgit.github.io * Mon Oct 19 2020 Marcin Dulak <Marcin.Dulak@gmail.com> - 7.0.2-2 - Set OMP_NUM_THREADS=1 https://github.com/edoapra/fedpkg/issues/10#issuecomment-699276160 - Fix hostname br for el6 * Thu Oct 15 2020 Edoardo Aprà <edoardo.apra@gmail.com> - 7.0.2-1 - new 7.0.2 release * Fri Aug 28 2020 Iñaki Úcar <iucar@fedoraproject.org> - 7.0.0-11 - https://fedoraproject.org/wiki/Changes/FlexiBLAS_as_BLAS/LAPACK_manager * Tue Jul 28 2020 Fedora Release Engineering <releng@fedoraproject.org> - 7.0.0-10 - Rebuilt for https://fedoraproject.org/wiki/Fedora_33_Mass_Rebuild
Generated by rpm2html 1.8.1
Fabrice Bellet, Thu May 9 19:58:19 2024