-------------------------------------------------------------------------------- Fedora EPEL Update Notification FEDORA-EPEL-2018-4c7984b8c2 2018-11-29 00:43:33.110419 --------------------------------------------------------------------------------
Name : gromacs Product : Fedora EPEL 7 Version : 2018.4 Release : 1.el7 URL : http://www.gromacs.org 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.
-------------------------------------------------------------------------------- Update Information:
Version bump to 2018.4 ---- Enable some OpenCL builds ---- Version bump to 2018.3 --------------------------------------------------------------------------------
This update can be installed with the "yum" update programs. Use su -c 'yum update gromacs' at the command line. For more information, refer to "YUM", available at https://access.redhat.com/documentation/en-US/Red_Hat_Enterprise_Linux/7%5C /html/System_Administrators_Guide/ch-yum.html
All packages are signed with the Fedora EPEL GPG key. More details on the GPG keys used by the Fedora Project can be found at https://fedoraproject.org/keys --------------------------------------------------------------------------------
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