fedora
Click here to visit the old openkoji buildsystem (Archived)

Information for build gromacs-2024.5-1.fc42

ID110961
Package Namegromacs
Links Fedora Package Sources | Fedora Official Koji Buildsystem | Rocks RISC-V Koji Buildsystem | Fedora RISC-V GitHub | Old Koji Buildsystem
Version2024.5
Release1.fc42
Epoch
DraftFalse
Sourcegit+https://src.fedoraproject.org/rpms/gromacs.git#1fdfef333e4b1bf05578f5e993a0eb6201f46bcf
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 bykojiadmin
State failed
Volume DEFAULT
StartedFri, 02 May 2025 07:54:50 CST
CompletedFri, 02 May 2025 08:51:35 CST
Taskbuild (f42, /rpms/gromacs.git:1fdfef333e4b1bf05578f5e993a0eb6201f46bcf)
Extra{'source': {'original_url': 'git+https://src.fedoraproject.org/rpms/gromacs.git#1fdfef333e4b1bf05578f5e993a0eb6201f46bcf'}}
Tags No tags
RPMs No RPMs
Changelog * Sat Jan 25 2025 Christoph Junghans <junghans@votca.org> - 2024.5-1 - Version bump to v2024.5 (bug #2341964) * Fri Jan 24 2025 Christoph Junghans <junghans@votca.org> - 2024.4-4 - Fix build with gcc-15 (bug #2340576) - Drop heffte support again, only work with cuda for now * Fri Jan 17 2025 Fedora Release Engineering <releng@fedoraproject.org> - 2024.4-3 - Rebuilt for https://fedoraproject.org/wiki/Fedora_42_Mass_Rebuild * Thu Dec 12 2024 Andrey Alekseenko <al42and@gmail.com> - 2024.4-2 - Correct SPDX license ID - Update build-time CMake dependency and remove X11 dependency - Remove unused CMake argument - Remove unused bundled code - Add overscribe environment variable for openmpi 5+ * Fri Nov 01 2024 Christoph Junghans <junghans@votca.org> - 2024.4-1 - Version bump to v2024.4 (bug #2322950) - Enable HeFFTE support * Tue Sep 03 2024 Christoph Junghans <junghans@votca.org> - 2024.3-1 - Version bump to v2024.3 (bug #2309068) * Fri Jul 26 2024 Miroslav Suchý <msuchy@redhat.com> - 2024.1-3 - convert license to SPDX * Thu Jul 18 2024 Fedora Release Engineering <releng@fedoraproject.org> - 2024.1-2 - Rebuilt for https://fedoraproject.org/wiki/Fedora_41_Mass_Rebuild * 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