Mon, 02 Dec 2024 00:18:22 UTC | login

Information for build gromacs-2023.3-1.fc40

ID269291
Package Namegromacs
Version2023.3
Release1.fc40
Epoch
Sourcegit+https://src.fedoraproject.org/rpms/gromacs.git#a024f613b2024cb348e3a607e6609b5772499b66
SummaryFast, Free and Flexible Molecular Dynamics
DescriptionGROMACS is a versatile and extremely well optimized package to perform molecular dynamics computer simulations and subsequent trajectory analysis. It is developed for bio-molecules like proteins, but the extremely high performance means it is used also in several other field like polymer chemistry and solid state physics. This package provides single and double precision binaries. The documentation is in the package gromacs-common. mdrun has been compiled with thread parallellization, so it runs in parallel on shared memory systems. If you want to run on a cluster, you probably want to install one of the MPI parallellized packages. N.B. All binaries have names starting with g_, for example mdrun has been renamed to g_mdrun.
Built bydavidlt
State canceled
Volume DEFAULT
StartedTue, 02 Jan 2024 10:45:05 UTC
CompletedTue, 02 Jan 2024 18:01:13 UTC
Taskbuild (f40, /rpms/gromacs.git:a024f613b2024cb348e3a607e6609b5772499b66)
Extra{'source': {'original_url': 'git+https://src.fedoraproject.org/rpms/gromacs.git#a024f613b2024cb348e3a607e6609b5772499b66'}}
Tags No tags
RPMs No RPMs
Changelog * Fri Nov 10 2023 Christoph Junghans <junghans@votca.org> - 2023.3-1 - Version bump v2023.3 (bug #2143353) * Thu Jul 20 2023 Fedora Release Engineering <releng@fedoraproject.org> - 2022.3-4 - Rebuilt for https://fedoraproject.org/wiki/Fedora_39_Mass_Rebuild * Thu Jan 19 2023 Fedora Release Engineering <releng@fedoraproject.org> - 2022.3-3 - Rebuilt for https://fedoraproject.org/wiki/Fedora_38_Mass_Rebuild * Wed Sep 28 2022 Christoph Junghans <junghans@votca.org> - 2022.3-2 - Rebuild for muparser * Fri Sep 02 2022 Fedora Release Monitoring <release-monitoring@fedoraproject.org> - 2022.3-1 - Update to 2022.3 (#2123647) * Thu Jul 21 2022 Fedora Release Engineering <releng@fedoraproject.org> - 2022.2-2 - Rebuilt for https://fedoraproject.org/wiki/Fedora_37_Mass_Rebuild * Fri Jun 17 2022 Christoph Junghans <junghans@votca.org> - 2022.2-1 - Version bump to v2022.2 (bug #2097747) * Fri Apr 22 2022 Christoph Junghans <junghans@votca.org> - 2022.1-1 - Version bump to v2022.1 (bug #2057081) * Sat Jan 29 2022 Christoph Junghans <junghans@votca.org> - 2021.5-1 - Version bump to v2021.5 (bug #1787785) * Thu Jan 20 2022 Fedora Release Engineering <releng@fedoraproject.org> - 2019.6-11 - Rebuilt for https://fedoraproject.org/wiki/Fedora_36_Mass_Rebuild