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debichem (0.0.11) unstable; urgency=medium
* Team upload.
[ Andreas Tille ]
* DEP5 copyright
[ Filippo Rusconi ]
* tasks/analytical-biochemistry: Added minexpert2, xtpcpp, toppic as Depends,
and libpwizlite-dev and libisospec++-dev as Suggests.
* tasks/analytical-biochemistry: Update description.
[ Michael Banck ]
* tasks/cheminformatics: Added libopenchemlib-java.
* tasks/development: Added libopenmm-dev and libsymspg-dev.
* tasks/input-generation-output-processing: Addedd c2x and python3-pycifrw.
* tasks/molecular-modelling: Added mmb and openstructure.
* tasks/periodic-abinitio: Added wannier90.
-- Michael Banck <mbanck@debian.org> Sun, 07 Feb 2021 23:42:29 +0100
debichem (0.0.10) unstable; urgency=medium
* Team upload.
* Remove final Python 2 module packages (Closes: #945634).
-- Stuart Prescott <stuart@debian.org> Sun, 12 Jan 2020 23:59:53 +1100
debichem (0.0.9) unstable; urgency=medium
* Team Upload.
[ Graham Inggs ]
* tasks/input-generation-output-processing: python-ase is now ase
* tasks/input-generation-output-processing: remove p4vasp, see #937227
* tasks/visualisation: ditto
[ Stuart Prescott ]
* Remove dependency on libblacs-mpi-dev (Closes: #878019).
* Stop mentioning removed packages (Closes: #891804).
* Update Standards-Version to 4.4.1 (no changes required).
* Add Rules-Requires-Root: no.
* Switch to debhelper-compat (= 12).
-- Stuart Prescott <stuart@debian.org> Fri, 10 Jan 2020 00:48:52 +1100
debichem (0.0.8) unstable; urgency=medium
* Depends: ${misc:Depends} for debichem-tasks
* lintian-override for false positive
* Re-render tasks with Buster release state
-- Andreas Tille <tille@debian.org> Thu, 13 Jun 2019 09:16:07 +0200
debichem (0.0.7) unstable; urgency=medium
* Moved from Alioth to Salsa
* Standards-Version: 4.3.0
* Priority: optional
-- Andreas Tille <tille@debian.org> Mon, 14 Jan 2019 19:49:32 +0100
debichem (0.0.6) unstable; urgency=medium
[ Michael Banck ]
* tasks/modelling: Added ballview.
* tasks/visualization: Removed travis.
* tasks/view-edit-2d: Update task title and description.
* tasks/abinitio: Split up to ...
* tasks/molecular-abinitio: ... this and ...
* tasks/periodic-abinitio: ... this.
* tasks/molmech: Renamed to ...
* tasks/molecular-dynamics: ... this.
* tasks/molecular-dynamics: Removed ghemical, avogadro and vmd, added
dl-poly-classic, cp2k and nwchem.
* tasks/polymer: Renamed to ...
* tasks/analytical-biochemistry: ... this.
* tasks/input-generation-output-processing: New task.
* tasks/development: New task.
* tasks/molecular-abinitio, tasks/molecular-dynamics,
tasks/periodic-abinitio: Update task title and description.
* tasks/molecular-abinitio: Added bagel.
* tasks/molecular-abinitio: Replaced libchemps2 with chemps2.
* tasks/periodic-abinitio: Added gpaw.
* tasks/molecular-abinitio: Added mpqc3.
* tasks/development: Added libga-dev.
* tasks/modelling: Renamed to ...
* tasks/molecular-modelling: ... this.
[ Andreas Tille ]
* rebuild using blends-dev 0.6.95
* source/format: 3.0 (native)
* Bump Standards-Version and debhelper compat level
-- Michael Banck <mbanck@debian.org> Tue, 24 Jan 2017 22:33:29 +0100
debichem (0.0.5) unstable; urgency=medium
* debian/source/format: Removed.
-- Michael Banck <mbanck@debian.org> Mon, 08 Dec 2014 20:53:53 +0100
debichem (0.0.4) unstable; urgency=medium
[ Michael Banck ]
* tasks/abinitio: Added psi4.
* tasks/crystallography: New task, including shelxle and xcrysden.
* tasks/visualisation: Moved gcrystal to ...
* tasks/crystallography: ... this.
* tasks/crystallography: Added python-fabio.
* tasks/molmech: Added lammps.
* tasks/semiempirical: Added molds.
* tasks/abinitio: Added elk-lapw.
* tasks/abinitio: Added ergo.
* tasks/visualisation, tasks/crystallography: Added gamgi.
* tasks/visualisation: Added p4vasp.
* tasks/visualisation: Added travis.
* tasks/molmech: Added votca-csg.
* tasks/polymer: Changed r-cran-mixtools and r-other-amsmercury Suggests to
Depends.
* tasks/polymer: Added r-other-iwrlars.
[ Daniel Leidert ]
* tasks/crystallography: Added drawxtl.
[ Andreas Tille ]
* d/source/format: 3.0 (native)
-- Michael Banck <mbanck@debian.org> Fri, 05 Dec 2014 16:45:37 +0100
debichem (0.0.3) unstable; urgency=low
[ Michael Banck ]
* tasks/visualisation: Added jmol and qutemol.
* tasks/visualisation: Added cclib.
* tasks/semiempirical: Added cp2k.
* tasks/cheminformatics: Added python-indigo.
* tasks/visualization: Added shelxle, xcrysden and drawxtl.
* tasks/cheminformatics: Added python-fmcs, python-chemfp and libopsin-java.
* tasks/visualization: Added gamgi.
* tasks/molmech, tasks/visualization, tasks/cheminformatics: Removed some
citation data which is already present in the respective debian/upstream
files.
* tasks/visualization: Added ballview, raster3d and kalzium.
[ Daniel Leidert ]
* debian/control.stub (Standards-Version): Bumped to 3.9.3.
(Vcs-Browser): Adjusted.
-- Michael Banck <mbanck@debian.org> Sun, 24 Feb 2013 16:30:10 +0100
debichem (0.0.2) unstable; urgency=low
[ Andreas Tille ]
* tasks/modelling: Added python-mmtk and nmoldyn.
* tasks/visualisation: Added publication info to rasmol.
* tasks/view-edit-2d: Added osra as prospective package.
[ Michael Banck ]
* tasks/abinitio: Added nwchem, aces3, cp2k and quantum-espresso.
* Added and/or updated publication/registration info for adun.app, gromacs,
massxpert, mmass, gabedit, rasmol, psi3, abinit, nwchem, aces3 and
quantum-espresso.
* tasks/cheminformatics: New task.
* debian/control: Updated.
-- Michael Banck <mbanck@debian.org> Tue, 01 Nov 2011 23:53:00 +0100
debichem (0.0.1) unstable; urgency=low
* Initial release. (Closes: #589042)
-- Andreas Tille <tille@debian.org> Mon, 19 Jul 2010 22:44:13 +0200
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