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Bug 33001 - new ebuild : molden - a MOLecular DENsity visualization package
Summary: new ebuild : molden - a MOLecular DENsity visualization package
Status: RESOLVED FIXED
Alias: None
Product: Gentoo Linux
Classification: Unclassified
Component: New packages (show other bugs)
Hardware: x86 Linux
: High normal (vote)
Assignee: Gentoo Science Related Packages
URL: http://www.cmbi.kun.nl/~schaft/molden...
Whiteboard:
Keywords: EBUILD
Depends on:
Blocks:
 
Reported: 2003-11-08 05:18 UTC by Rossen Apostolov
Modified: 2003-11-09 23:15 UTC (History)
0 users

See Also:
Package list:
Runtime testing required: ---


Attachments
new ebuild (molden-3.9.ebuild,703 bytes, text/plain)
2003-11-08 05:19 UTC, Rossen Apostolov
Details
a patch that fixes the makefile (molden-fixMakefile.patch,844 bytes, patch)
2003-11-08 05:20 UTC, Rossen Apostolov
Details | Diff

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Description Rossen Apostolov 2003-11-08 05:18:37 UTC
This a  package for displaying Molecular Density from the Ab Initio packages 
GAMESS-UK , GAMESS-US and GAUSSIAN and the Semi-Empirical packages Mopac/Ampac.
It also supports a number of other programs via the Molden Format. 
The ebuild is quite quick and dirty but it works for me. Maybe someone will find
it useful
and probably also help to improve it. 
New version molden-4.0 is also on the way...

Reproducible: Always
Steps to Reproduce:
Comment 1 Rossen Apostolov 2003-11-08 05:19:28 UTC
Created attachment 20424 [details]
new ebuild
Comment 2 Rossen Apostolov 2003-11-08 05:20:32 UTC
Created attachment 20425 [details, diff]
a patch that fixes the makefile
Comment 3 Rossen Apostolov 2003-11-08 05:23:00 UTC
Category suggestion : "app-sci" 
Comment 4 Donnie Berkholz (RETIRED) gentoo-dev 2003-11-09 21:50:16 UTC
I just committed an ebuild for this. Take a look, try it out, suggest changes.
Thanks!
Comment 5 Rossen Apostolov 2003-11-09 23:01:28 UTC
what's the name of this ebuild? I can't find it...
Comment 6 Rossen Apostolov 2003-11-09 23:15:21 UTC
sorry, i didn't check the cvs:)
very stupid...