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Name: packmol | Distribution: Fedora Project |
Version: 20.15.1 | Vendor: Fedora Project |
Release: 2.fc42 | Build date: Fri Jan 17 23:29:03 2025 |
Group: Unspecified | Build host: buildvm-a64-15.iad2.fedoraproject.org |
Size: 399474 | Source RPM: packmol-20.15.1-2.fc42.src.rpm |
Packager: Fedora Project | |
Url: http://m3g.iqm.unicamp.br/packmol/home.shtml | |
Summary: Packing optimization for molecular dynamics simulations |
Packmol creates an initial point for molecular dynamics simulations by packing molecules in defined regions of space. The packing guarantees that short range repulsive interactions do not disrupt the simulations. The great variety of types of spatial constraints that can be attributed to the molecules, or atoms within the molecules, makes it easy to create ordered systems, such as lamellar, spherical or tubular lipid layers. The user must provide only the coordinates of one molecule of each type, the number of molecules of each type and the spatial constraints that each type of molecule must satisfy. The package is compatible with input files of PDB, TINKER, XYZ and MOLDY formats.
MIT
* Fri Jan 17 2025 Fedora Release Engineering <releng@fedoraproject.org> - 20.15.1-2 - Rebuilt for https://fedoraproject.org/wiki/Fedora_42_Mass_Rebuild * Sat Aug 17 2024 Susi Lehtola <jussilehtola@fedoraproject.org> - 20.15.1-1 - Update to 20.15.1. * Thu Jul 18 2024 Fedora Release Engineering <releng@fedoraproject.org> - 20.14.2-5 - Rebuilt for https://fedoraproject.org/wiki/Fedora_41_Mass_Rebuild * Thu Jan 25 2024 Fedora Release Engineering <releng@fedoraproject.org> - 20.14.2-4 - Rebuilt for https://fedoraproject.org/wiki/Fedora_40_Mass_Rebuild * Sun Jan 21 2024 Fedora Release Engineering <releng@fedoraproject.org> - 20.14.2-3 - Rebuilt for https://fedoraproject.org/wiki/Fedora_40_Mass_Rebuild * Thu Jul 20 2023 Fedora Release Engineering <releng@fedoraproject.org> - 20.14.2-2 - Rebuilt for https://fedoraproject.org/wiki/Fedora_39_Mass_Rebuild * Fri Jul 14 2023 Susi Lehtola <jussilehtola@fedoraproject.org> - 20.14.2-1 - Update to 20.14.2. * Thu Jan 19 2023 Fedora Release Engineering <releng@fedoraproject.org> - 20.11.1-2 - Rebuilt for https://fedoraproject.org/wiki/Fedora_38_Mass_Rebuild
/usr/bin/packmol /usr/bin/packmol_solvate /usr/lib/.build-id /usr/lib/.build-id/cc /usr/lib/.build-id/cc/4f9fd66ac60b38deb324055d80e521b23ddf82 /usr/share/doc/packmol /usr/share/doc/packmol/AUTHORS /usr/share/licenses/packmol /usr/share/licenses/packmol/LICENSE
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Fabrice Bellet, Fri Jan 24 01:46:23 2025