Fedora 12 Update: towhee-6.2.12-1.fc12
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Fedora Update Notification
FEDORA-2010-13376
2010-08-23 21:39:50
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Name : towhee
Product : Fedora 12
Version : 6.2.12
Release : 1.fc12
URL : http://towhee.sourceforge.net/
Summary : A Monte Carlo molecular simulation code
Description :
Towhee is a Monte Carlo molecular simulation code originally designed for the
prediction of fluid phase equilibria using atom-based force fields and the
Gibbs ensemble with particular attention paid to algorithms addressing
molecule conformation sampling. The code has subsequently been extended to
several ensembles, many different force fields, and solid (or at least porous)
phases.
This package contains binaries for serial operation and the utilities.
N.B. Due to some general names the utilities have a towhee- prefix, e.g.
analyse_movie is now towhee-analyse_movie.
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Update Information:
New angle distribution (bounded Sine) to automatically handle angle generation
for linear molecules that use the infinite square well angle potential. Added
automatic detection to use an improved bounded r^2 potential for bond lengths
that have an infinite square well potential. Incorporated a bug fix for the 1
box com switch move to resolve a problem that was occurring when using the move
in a simulation that had more than 1 box.
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ChangeLog:
* Wed Aug 18 2010 Jussi Lehtola <jussilehtola(a)fedoraproject.org> - 6.2.12-1
- Update to 6.2.12.
* Sat Jul 24 2010 Jussi Lehtola <jussilehtola(a)fedoraproject.org> - 6.2.11-1
- Update to 6.2.11.
* Sat Jun 19 2010 Jussi Lehtola <jussilehtola(a)fedoraproject.org> - 6.2.9-1
- Update to 6.2.9.
* Sat Dec 19 2009 Jussi Lehtola <jussilehtola(a)fedoraproject.org> - 6.2.7-1
- Adopt MPI guidelines, fixing FTBFS in rawhide.
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This update can be installed with the "yum" update program. Use
su -c 'yum update towhee' 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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