Category Sciences/Chemistry

avogadro Mar 22, 2014, 01:42 AMMar 22, 2014, 01:42 AM
Version: 1.1.1-alt0.M70P.1
Summary: An advanced molecular editor for chemical purposes
Changelog:
- built for M70P
gnome-chemistry-utils Sep 1, 2013, 11:31 PMSep 1, 2013, 11:31 PM
Version: 0.14.2-alt6
Summary: A set of chemical utilities
Changelog:
- rebuilt for new gnumeric-1.12.7
gperiodic Apr 17, 2013, 01:25 AMApr 17, 2013, 01:25 AM
Version: 2.0.10-alt4.qa1
Summary: Program for browsing the periodic table
Changelog:
- NMU: rebuilt for debuginfo.
abinit Apr 17, 2013, 01:12 AMApr 17, 2013, 01:12 AM
Version: 6.0.4-alt1.qa1
Summary: Computational Chemistry DFT program
Changelog:
- NMU: rebuilt for debuginfo.
platon Apr 13, 2013, 04:47 PMApr 13, 2013, 04:47 PM
Version: 20130410-alt1
Summary: PLATON is a versatile SHELX97 compatible multipurpose crystallographic tool
Changelog:
- new version
shelxle Apr 11, 2013, 07:17 PMApr 11, 2013, 07:17 PM
Version: 1.0.618-alt1
Summary: A Qt GUI for SHELX
Changelog:
- new version
gromacs-gui Dec 5, 2012, 03:17 PMDec 5, 2012, 03:17 PM
Version: 0.5.2-alt6
Summary: GUI for molecular dynamics package, GROMACS
Changelog:
- Fixed build with glibc 2.16
mmcalc Dec 2, 2012, 09:40 AMDec 2, 2012, 09:40 AM
Version: 20121202-alt1
Summary: Molar Mass Calculator
Changelog:
- new version
xdrawchem Nov 7, 2012, 09:49 AMNov 7, 2012, 09:49 AM
Version: 1.9.9-alt3.qa3
Summary: XDrawChem is a two-dimensional molecule drawing program
Changelog:
- Fixed build with glibc 2.16
pymol Oct 5, 2012, 07:09 PMOct 5, 2012, 07:09 PM
Version: 1.2_b3-alt2.svn20090726.4
Summary: Python-enhanced molecular graphics tool
Changelog:
- Rebuilt with libpng15
chemtool Aug 16, 2012, 01:27 PMAug 16, 2012, 01:27 PM
Version: 1.6.13-alt3
Summary: A program for 2D drawing organic molecules
Changelog:
- oops, desktop-file-validate skipped (thx repocop)
gromacs Aug 12, 2012, 12:18 AMAug 12, 2012, 12:18 AM
Version: 4.0.7-alt8
Summary: Molecular dynamics package
Changelog:
- Built with OpenBLAS instead of GotoBLAS2
RasMol Apr 22, 2012, 04:44 PMApr 22, 2012, 04:44 PM
Version: 2.7.5.2-alt3
Summary: Molecular Graphics Visualisation Tool
Changelog:
- rebuilt with current NearTree
openbabel Apr 16, 2012, 06:51 PMApr 16, 2012, 06:51 PM
Version: 2.3.1-alt1.1.1
Summary: Chemistry software file format converter
Changelog:
- Rebuild to remove redundant libpython2.7 dependency
bodr Aug 26, 2011, 08:53 AMAug 26, 2011, 08:53 AM
Version: 9-alt1
Summary: Blue Obelisk Data Repository
Changelog:
- new version
xcrysden Jun 25, 2011, 01:42 PMJun 25, 2011, 01:42 PM
Version: 1.5.21-alt4
Summary: X-window CRYstalline Structure and DENsities
Changelog:
- BR += libXext-devel
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