| ID | 47018 | ||||||||||||||||||||||||||||||||
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| Package Name | gromacs | ||||||||||||||||||||||||||||||||
| Links | Fedora Package Sources | Fedora Official Koji Buildsystem | Rocks RISC-V Koji Buildsystem | Fedora RISC-V GitHub | Old Koji Buildsystem | ||||||||||||||||||||||||||||||||
| Version | 2024.1 | ||||||||||||||||||||||||||||||||
| Release | 1.fc41 | ||||||||||||||||||||||||||||||||
| Epoch | Draft | False | |||||||||||||||||||||||||||||||
| Source | git+https://src.fedoraproject.org/rpms/gromacs.git#bc1b0e18b29c0654eaef9deba377e94947381977 | ||||||||||||||||||||||||||||||||
| Summary | Fast, Free and Flexible Molecular Dynamics | ||||||||||||||||||||||||||||||||
| Description | GROMACS 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 by | kojiadmin | ||||||||||||||||||||||||||||||||
| State | complete | ||||||||||||||||||||||||||||||||
| Volume | DEFAULT | ||||||||||||||||||||||||||||||||
| Started | Tue, 07 May 2024 08:39:37 CST | ||||||||||||||||||||||||||||||||
| Completed | Tue, 07 May 2024 20:13:02 CST | ||||||||||||||||||||||||||||||||
| Task | build (f41, /rpms/gromacs.git:bc1b0e18b29c0654eaef9deba377e94947381977) | ||||||||||||||||||||||||||||||||
| Extra | {'source': {'original_url': 'git+https://src.fedoraproject.org/rpms/gromacs.git#bc1b0e18b29c0654eaef9deba377e94947381977'}} | ||||||||||||||||||||||||||||||||
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| Changelog | * Fri May 03 2024 Christoph Junghans <junghans@votca.org> - 2024.1-1 - Version bump to v2024.1 (bug #2261951) * Tue Jan 30 2024 Christoph Junghans <junghans@votca.org> - 2024-1 - Version bump to v2024 (bug #2261951) * Wed Jan 24 2024 Christoph Junghans <junghans@votca.org> - 2023.4-1 - Version bump to v2023.4 (bug#2260114) * Wed Jan 24 2024 Fedora Release Engineering <releng@fedoraproject.org> - 2023.3-3 - Rebuilt for https://fedoraproject.org/wiki/Fedora_40_Mass_Rebuild * Sat Jan 20 2024 Fedora Release Engineering <releng@fedoraproject.org> - 2023.3-2 - Rebuilt for https://fedoraproject.org/wiki/Fedora_40_Mass_Rebuild * 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) |