-------------------------------------------------------------------------------- Fedora EPEL Update Notification FEDORA-EPEL-2014-1652 2014-06-14 19:14:37 --------------------------------------------------------------------------------
Name : nwchem Product : Fedora EPEL 6 Version : 6.3.2 Release : 11.el6 URL : http://www.nwchem-sw.org/ Summary : Delivering High-Performance Computational Chemistry to Science Description :
NWChem aims to provide its users with computational chemistry tools that are scalable both in their ability to treat large scientific computational chemistry problems efficiently, and in their use of available parallel computing resources from high-performance parallel supercomputers to conventional workstation clusters.
Please cite the following reference when publishing results obtained with NWChem: M. Valiev, E.J. Bylaska, N. Govind, K. Kowalski, T.P. Straatsma, H.J.J. van Dam, D. Wang, J. Nieplocha, E. Apra, T.L. Windus, W.A. de Jong, "NWChem: a comprehensive and scalable open-source solution for large scale molecular simulations" Comput. Phys. Commun. 181, 1477 (2010)
There is currently no serial version built.
-------------------------------------------------------------------------------- Update Information:
many tests are failing on Fedora 21 i686 - excluding all the tests but two on this platform -------------------------------------------------------------------------------- References:
[ 1 ] Bug #1106915 - nwchem: FTBFS in rawhide https://bugzilla.redhat.com/show_bug.cgi?id=1106915 --------------------------------------------------------------------------------
This update can be installed with the "yum" update programs. Use su -c 'yum update nwchem' at the command line. For more information, refer to "Managing Software with yum", available at http://docs.fedoraproject.org/yum/.
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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