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Old 04-09-2011, 08:48 PM
Nicholas Breen
 
Default Bug#621874: ITP: votca -- Versatile Object-oriented Toolkit for Coarse-graining Applications

Package: wnpp
Severity: wishlist
Owner: Nicholas Breen <nbreen@ofb.net>

* Package name : votca
Version : 1.1.2
Upstream Author : VOTCA Developers <devs@votca.org>
* URL : http://www.votca.org/
* License : Apache License 2.0
Programming Lang: C++
Description : Versatile Object-oriented Toolkit for Coarse-graining Applications

A toolkit intended to reduce the amount of routine work when doing systematic
coarse-graining of various systems, e.g. in molecular modeling and other
theoretical chemistry applications.
.
The toolkit is described in J. Chem. Theory Comput., 2009, 5(12), 3211-3223,
<http://pubs.acs.org/doi/abs/10.1021/ct900369w>.



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