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Bug#641655: marked as done (RFP: xtalopt -- Evolutionary Crystal Structure Prediction)



Your message dated Tue, 10 Jul 2018 16:20:17 +0000
with message-id <E1fcvNB-0008PA-KU@quantz.debian.org>
and subject line closing RFP: xtalopt -- Evolutionary Crystal Structure Prediction
has caused the Debian Bug report #641655,
regarding RFP: xtalopt -- Evolutionary Crystal Structure Prediction
to be marked as done.

This means that you claim that the problem has been dealt with.
If this is not the case it is now your responsibility to reopen the
Bug report if necessary, and/or fix the problem forthwith.

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-- 
641655: https://bugs.debian.org/cgi-bin/bugreport.cgi?bug=641655
Debian Bug Tracking System
Contact owner@bugs.debian.org with problems
--- Begin Message ---
Package: wnpp
Severity: wishlist
Owner: Debichem Team <debichem-devel@lists.alioth.debian.org>


* Package name    : xtalopt
  Version         : r8.0
  Upstream Author : David Lonie
* URL             : http://xtalopt.openmolecules.net
* License         : GPLv2, LGPLv2 and BSD
  Programming Lang: C, C++
  Description     : Evolutionary Crystal Structure Prediction

 XtalOpt is an evolutionary algorithm designed to predict crystal
 structures. It is implemented as an extension to the Avogadro molecular
 editor.
 .
 XtalOpt runs on a workstation and supports using Quantum ESPRESSO,
 GULP, VASP and CASTEP for geometry optimizations. The calculations can
 be performed remotely on a cluster running PBS or SGE, or on the
 workstation if a computing cluster is not available.


Cheers,

Michael



--- End Message ---
--- Begin Message ---
RFP 641655 has no visible progress for a long time, so closing.

--- End Message ---

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