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| Name: jmol | Distribution: SUSE Linux Enterprise 15 SP4 |
| Version: 14.31.20 | Vendor: openSUSE |
| Release: bp154.1.23 | Build date: Mon May 9 11:12:27 2022 |
| Group: Productivity/Scientific/Chemistry | Build host: cloud113 |
| Size: 7510935 | Source RPM: jmol-14.31.20-bp154.1.23.src.rpm |
| Packager: https://bugs.opensuse.org | |
| Url: http://jmol.sf.net/ | |
| Summary: 3D Viewer for chemical structures | |
Jmol is a Java-based viewer for chemical structures in 3D with features for chemicals, crystals, materials and biomolecules.
LGPL-2.1-only
* Mon Feb 08 2021 Jan Engelhardt <jengelh@inai.de>
- update build recipes/scripts to use https [boo#1181924]
- Redownload Source2 because it was some HTML content rather than
a PNG file
* Thu Dec 24 2020 Jan Engelhardt <jengelh@inai.de>
- Update to release 14.31.20
* Topology CIF reading of _topol_xxx records
* GenNBOReader supports older NBO 3.0 output.properties
rather than missing .46 labels file
* NBO command expanded to allow named orbitals
* Thu Dec 19 2019 Jan Engelhardt <jengelh@inai.de>
- Update to release 14.30.1
* new feature: (undocumented) set picking dragMolecule
* new feature: set picking dragModel
* Sat Oct 20 2018 Jan Engelhardt <jengelh@inai.de>
- Update to new upstream release 14.29.26
* Fixed: Magnetic CIF reader did not handle symmetry operations
with n/16.
* Fixed: 3-membered aziridine with non-H substituent should
be chiral.
* Fri Jan 19 2018 jengelh@inai.de
- Drop bundled jsmol and jspecview from package.
* Mon Dec 25 2017 jengelh@inai.de
- Update to new upstream release 14.27.2
* new feature: frame MO - goes to first frame with a molecular orbital
* new feature: functions write("zip") and write("jmol")
- Remove fsf-address.patch
* Sat Jul 16 2016 thod_@gmx.de
- update to version 14.6.1
some bug fixes
* Sat May 28 2016 thod_@gmx.de
- Add manual
- Split desktop file
- update to version 14.6.0
selected new feature:
* CONNECT {pair1} {pair2} ATROPISOMER
* C13 NMR prediction from http://www.nmrdb.org/service/jsmol13c?smiles=CCCC
* Jmol SMILES bond atropisomerism ^nm- and ^^nm-
* SMILES/nonaromatic same as SMILES/noaromatic
* adds SHOW SMILES/bio and {*}.find("SMILES/bio") options:
* print {*}.find("SMILES/hydrogen/") adds hydrogen atoms
* Jmol now implements a way of indicating atropisomer chirality.
* full implementation of OpenSMILES and OpenSMARTS in Jmol
* Polyhedra command allows for min and max radius
* draw POINTGROUP SPACEGROUP
* draw SPACEGROUP
* print pointgroup("spacegroup", @1)
* show spacegroup/xxxxx
* show symop 3 @3 "atom"
* show/draw symop @1 @2
* show/draw symop @1 @2 n
* symop() options
* symop(3,@3,"atom")
* getProperty("shapeInfo.echo")
* preliminary MMTF reader
* set window width height
* set window "xxx.png"
* setting DSSR on the fly
* show chemical xxx where xxx is a file type
and many bug fixes
* Sun Mar 13 2016 jengelh@inai.de
- Update to new upstream release 14.5.0
* bug fix: restoring bonds to a model having fewer bonds than the
model for which they were saved throws an exception
* bug fix for "WRITE xxx.ZIP" command crashing Jmol
* Fri Mar 27 2015 jengelh@inai.de
- Update to new upstream release 14.3.13
* No overview was provided
* Mon Feb 02 2015 jengelh@inai.de
- Update to new upstream release 14.3.12
* No overview was provided
/usr/bin/jmol /usr/share/applications/jmol.desktop /usr/share/doc/packages/jmol /usr/share/doc/packages/jmol/CHANGES.txt /usr/share/doc/packages/jmol/README.txt /usr/share/jmol /usr/share/jmol/Jmol.jar /usr/share/licenses/jmol /usr/share/licenses/jmol/COPYRIGHT.txt /usr/share/licenses/jmol/LICENSE.txt /usr/share/man/man1/jmol.1.gz /usr/share/pixmaps/jmol.png
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Fabrice Bellet, Tue Apr 9 17:06:41 2024