Fedora 22 Update: nwchem-6.5.26243-15.fc22

updates at fedoraproject.org updates at fedoraproject.org
Tue Apr 21 19:20:11 UTC 2015


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Fedora Update Notification
FEDORA-2015-5300
2015-04-02 00:26:12
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Name        : nwchem
Product     : Fedora 22
Version     : 6.5.26243
Release     : 15.fc22
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.

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Update Information:

export EACCSD=Y
export IPCCSD=Y

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This update can be installed with the "yum" update program.  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 Project 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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