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jmol-14.2.2

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OBS-URL: https://build.opensuse.org/package/show/science/jmol?expand=0&rev=3
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Jan Engelhardt 2014-07-17 14:57:07 +00:00 committed by Git OBS Bridge
parent abee9df9f8
commit bf5d7b719b
4 changed files with 22 additions and 6 deletions
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3
Jmol-14.0.17_2014.06.10-binary.tar.gz
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version https://git-lfs.github.com/spec/v1
oid sha256:d6db27c1b2d1063acd51f3762dcd19358ad63fbf1829f5654360ec57978785bc
size 55906205

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Jmol-14.2.2_2014.06.29-binary.tar.gz Normal file
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version https://git-lfs.github.com/spec/v1
oid sha256:56c8c8ef21fe959cc94733a01f971b3fb0168460de8e4c3efca62360074b3cbe
size 58295921

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jmol.changes
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-------------------------------------------------------------------
Thu Jul 17 14:56:33 UTC 2014 - jengelh@inai.de
- update to version 14.2.2
* New features:
* readers with unit cells may load as trajectories
* protein sidechain minimization
* Bug fixes:
* CASTEP reader broken for multiple cells and geometry optimization
* set pdbAddHydrogens fails for structures with ANISOU records
* select x < 0.3 reports error when checking, though it does run
when executed
* SMILES for model with nonbonded atoms fails
* WebPanel error trapping problem; too long file name for tar file
------------------------------------------------------------------- -------------------------------------------------------------------
Wed Jun 11 14:21:37 UTC 2014 - jengelh@inai.de Wed Jun 11 14:21:37 UTC 2014 - jengelh@inai.de

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jmol.spec
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Name: jmol Name: jmol
Version: 14.0.17 Version: 14.2.2
Release: 0 Release: 0
%define date 2014.06.29
Summary: 3D Viewer for chemical structures Summary: 3D Viewer for chemical structures
License: LGPL-2.1 License: LGPL-2.1
Group: Productivity/Scientific/Chemistry Group: Productivity/Scientific/Chemistry
Url: http://jmol.sf.net/ Url: http://jmol.sf.net/
Source: http://downloads.sf.net/jmol/Jmol-%{version}_2014.06.10-binary.tar.gz Source: http://downloads.sf.net/jmol/Jmol-%{version}_%date-binary.tar.gz
Source2: Jmol_icon13.png Source2: Jmol_icon13.png
#Source2-Orig: http://wiki.jmol.org/index.php/File:Jmol_icon13.png #Source2-Orig: http://wiki.jmol.org/index.php/File:Jmol_icon13.png
Patch1: datadir.diff Patch1: datadir.diff
@ -39,7 +40,7 @@ Jmol is a Java-based viewer for chemical structures in 3D with
features for chemicals, crystals, materials and biomolecules. features for chemicals, crystals, materials and biomolecules.
%prep %prep
%setup -qn %name-%{version}_2014.06.10 %setup -qn %name-%{version}_%date
%patch -P 1 -p1 %patch -P 1 -p1
cp %{S:2} . cp %{S:2} .