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ghemical-2.10-3mdv2008.0 RPM for x86_64

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Name: ghemical Distribution: Mandriva Linux
Version: 2.10 Vendor: Mandriva
Release: 3mdv2008.0 Build date: Tue Mar 25 10:30:34 2008
Group: Sciences/Chemistry Build host: seggie.mandriva.com
Size: 3087386 Source RPM: ghemical-2.10-3mdv2008.0.src.rpm
Packager: Guillaume Bedot <littletux@mandriva.org>
Url: http://www.uku.fi/~thassine/ghemical/
Summary: Molecular mechanics and quantum mechanics frontend for GNOME
Ghemical is a computational chemistry software package released under the
GNU GPL.
Ghemical is written in C++. It has a graphical user interface (in fact,
a couple of them), and it supports both quantum-mechanics (semi-empirical
and ab initio) models and molecular mechanics models (there is an experimental
Tripos 5.2-like force field for organic molecules). Also a tool for reduced
protein models is included. Geometry optimization, molecular dynamics
and a large set of visualization tools are currently available.

Provides

Requires

License

GPL

Changelog

* Tue Mar 25 2008 Guillaume Bedot <littletux@mandriva.org> 2.10-3mdv2008.0
  + Revision: 189841
  - fix linking
  - fix buildrequires
  
    + Marcelo Ricardo Leitner <mrl@mandriva.com>
      - Branching 2008.0 Updates
  
    + Thierry Vignaud <tvignaud@mandriva.com>
      - kill desktop-file-validate's 'warning: key "Encoding" in group "Desktop Entry" is deprecated'
  
    + Austin Acton <austin@mandriva.org>
      - rebuild for openbabel
* Wed Aug 23 2006 Per Øyvind Karlsen <pkarlsen@mandriva.com> 2.10-0.1.20060mdk
  - 2.10
  - xdg menu
  - various fixesblablabla
* Thu Mar 09 2006 Per Øyvind Karlsen <pkarlsen@mandriva.com> 1.02-1mdk
  - 1.02
  - fix buildrequires
  - %mkrel

Files

/usr/bin/ghemical
/usr/lib/menu/ghemical
/usr/share/applications/mandriva-ghemical.desktop
/usr/share/doc/ghemical
/usr/share/doc/ghemical/AUTHORS
/usr/share/doc/ghemical/ChangeLog
/usr/share/doc/ghemical/NEWS
/usr/share/doc/ghemical/README
/usr/share/doc/ghemical/TODO
/usr/share/ghemical
/usr/share/ghemical/2.10
/usr/share/ghemical/2.10/examples
/usr/share/ghemical/2.10/examples/2-chlorobutane.gpr
/usr/share/ghemical/2.10/examples/3-phenylpropanal.gpr
/usr/share/ghemical/2.10/examples/PeriodicTable.gpr
/usr/share/ghemical/2.10/examples/acetylsalicylic_acid.gpr
/usr/share/ghemical/2.10/examples/alpha-pinene.gpr
/usr/share/ghemical/2.10/examples/bromobenzene.gpr
/usr/share/ghemical/2.10/examples/camphor.gpr
/usr/share/ghemical/2.10/examples/cinnamaldehyde.gpr
/usr/share/ghemical/2.10/examples/cis-2-pentene.gpr
/usr/share/ghemical/2.10/examples/cyclohexane.gpr
/usr/share/ghemical/2.10/examples/dna_AGTC.gpr
/usr/share/ghemical/2.10/examples/naphtalene.gpr
/usr/share/ghemical/2.10/examples/rna_aguc.gpr
/usr/share/ghemical/2.10/examples/transition_state_search
/usr/share/ghemical/2.10/examples/transition_state_search/E2-reaction
/usr/share/ghemical/2.10/examples/transition_state_search/E2-reaction/products.gpr
/usr/share/ghemical/2.10/examples/transition_state_search/E2-reaction/reactants.gpr
/usr/share/ghemical/2.10/examples/transition_state_search/E2-reaction/ts.gpr
/usr/share/ghemical/2.10/examples/transition_state_search/SN2-reaction
/usr/share/ghemical/2.10/examples/transition_state_search/SN2-reaction/products.gpr
/usr/share/ghemical/2.10/examples/transition_state_search/SN2-reaction/reactants.gpr
/usr/share/ghemical/2.10/examples/transition_state_search/SN2-reaction/ts.gpr
/usr/share/ghemical/2.10/examples/transition_state_search/carbocation_rearrangement_hydride_shift
/usr/share/ghemical/2.10/examples/transition_state_search/carbocation_rearrangement_hydride_shift/products.gpr
/usr/share/ghemical/2.10/examples/transition_state_search/carbocation_rearrangement_hydride_shift/reactants.gpr
/usr/share/ghemical/2.10/examples/transition_state_search/carbocation_rearrangement_hydride_shift/ts.gpr
/usr/share/ghemical/2.10/examples/transition_state_search/carbocation_rearrangement_methide_shift
/usr/share/ghemical/2.10/examples/transition_state_search/carbocation_rearrangement_methide_shift/products.gpr
/usr/share/ghemical/2.10/examples/transition_state_search/carbocation_rearrangement_methide_shift/reactants.gpr
/usr/share/ghemical/2.10/examples/transition_state_search/carbocation_rearrangement_methide_shift/ts.gpr
/usr/share/ghemical/2.10/examples/transition_state_search/cycloaddition_Diels-Alder
/usr/share/ghemical/2.10/examples/transition_state_search/cycloaddition_Diels-Alder/products.gpr
/usr/share/ghemical/2.10/examples/transition_state_search/cycloaddition_Diels-Alder/reactants.gpr
/usr/share/ghemical/2.10/examples/transition_state_search/cycloaddition_Diels-Alder/ts.gpr
/usr/share/ghemical/2.10/examples/transition_state_search/sigmatropic_rearrangement_Cope
/usr/share/ghemical/2.10/examples/transition_state_search/sigmatropic_rearrangement_Cope/products.gpr
/usr/share/ghemical/2.10/examples/transition_state_search/sigmatropic_rearrangement_Cope/reactants.gpr
/usr/share/ghemical/2.10/examples/transition_state_search/sigmatropic_rearrangement_Cope/ts.gpr
/usr/share/ghemical/2.10/examples/transition_state_search/tautomeric_shift_keto_enol
/usr/share/ghemical/2.10/examples/transition_state_search/tautomeric_shift_keto_enol/products.gpr
/usr/share/ghemical/2.10/examples/transition_state_search/tautomeric_shift_keto_enol/reactants.gpr
/usr/share/ghemical/2.10/examples/transition_state_search/tautomeric_shift_keto_enol/ts.gpr
/usr/share/ghemical/2.10/glade
/usr/share/ghemical/2.10/glade/constraint_dialog.glade
/usr/share/ghemical/2.10/glade/efp_dialog.glade
/usr/share/ghemical/2.10/glade/file_export_dialog.glade
/usr/share/ghemical/2.10/glade/file_import_dialog.glade
/usr/share/ghemical/2.10/glade/gamess_dialog.glade
/usr/share/ghemical/2.10/glade/geomopt_dialog.glade
/usr/share/ghemical/2.10/glade/moldyn_dialog.glade
/usr/share/ghemical/2.10/glade/progress_dialog.glade
/usr/share/ghemical/2.10/glade/setup_dialog.glade
/usr/share/ghemical/2.10/glade/trajview_dialog.glade
/usr/share/ghemical/2.10/pixmaps
/usr/share/ghemical/2.10/pixmaps/ghemical.png
/usr/share/ghemical/2.10/user-docs
/usr/share/ghemical/2.10/user-docs/MD.html
/usr/share/ghemical/2.10/user-docs/MD_viewer.html
/usr/share/ghemical/2.10/user-docs/aa_table.html
/usr/share/ghemical/2.10/user-docs/add_hydrogens.html
/usr/share/ghemical/2.10/user-docs/conf_search_tools.html
/usr/share/ghemical/2.10/user-docs/documentation.css
/usr/share/ghemical/2.10/user-docs/energy_vs_torsion.html
/usr/share/ghemical/2.10/user-docs/filetypes.html
/usr/share/ghemical/2.10/user-docs/formula.html
/usr/share/ghemical/2.10/user-docs/geometry_optimization.html
/usr/share/ghemical/2.10/user-docs/images
/usr/share/ghemical/2.10/user-docs/images/2atoms_unbonded.png
/usr/share/ghemical/2.10/user-docs/images/aa_builder_ci.png
/usr/share/ghemical/2.10/user-docs/images/aa_builder_menu.png
/usr/share/ghemical/2.10/user-docs/images/aa_builder_note.png
/usr/share/ghemical/2.10/user-docs/images/aa_builder_w_h.png
/usr/share/ghemical/2.10/user-docs/images/aa_builder_wo_h.png
/usr/share/ghemical/2.10/user-docs/images/add_hydrogens.png
/usr/share/ghemical/2.10/user-docs/images/add_hydrogens_select.png
/usr/share/ghemical/2.10/user-docs/images/change_bond_dialog.png
/usr/share/ghemical/2.10/user-docs/images/ci_plane.png
/usr/share/ghemical/2.10/user-docs/images/clipping1.png
/usr/share/ghemical/2.10/user-docs/images/clipping2.png
/usr/share/ghemical/2.10/user-docs/images/cyclohexane1.png
/usr/share/ghemical/2.10/user-docs/images/cyclohexane2.png
/usr/share/ghemical/2.10/user-docs/images/cyclohexane_optimized.png
/usr/share/ghemical/2.10/user-docs/images/cyclohexane_unoptimized.png
/usr/share/ghemical/2.10/user-docs/images/energy_vs_torsion1.png
/usr/share/ghemical/2.10/user-docs/images/energy_vs_torsion2.png
/usr/share/ghemical/2.10/user-docs/images/energy_vs_torsion3.png
/usr/share/ghemical/2.10/user-docs/images/energy_vs_torsion4.png
/usr/share/ghemical/2.10/user-docs/images/enlevdiag.png
/usr/share/ghemical/2.10/user-docs/images/esp-plane_mm.png
/usr/share/ghemical/2.10/user-docs/images/esp-plane_qm.png
/usr/share/ghemical/2.10/user-docs/images/esp-plane_select.png
/usr/share/ghemical/2.10/user-docs/images/esp-plane_select_obj.png
/usr/share/ghemical/2.10/user-docs/images/formula.png
/usr/share/ghemical/2.10/user-docs/images/formula_select.png
/usr/share/ghemical/2.10/user-docs/images/geometry_op_dialog.png
/usr/share/ghemical/2.10/user-docs/images/geometry_optimization_select.png
/usr/share/ghemical/2.10/user-docs/images/labels_menu.png
/usr/share/ghemical/2.10/user-docs/images/mainmenu.png
/usr/share/ghemical/2.10/user-docs/images/maintools.png
/usr/share/ghemical/2.10/user-docs/images/md_dialog.png
/usr/share/ghemical/2.10/user-docs/images/modal.png
/usr/share/ghemical/2.10/user-docs/images/notebook.png
/usr/share/ghemical/2.10/user-docs/images/optimized_ethane.png
/usr/share/ghemical/2.10/user-docs/images/remove_hydrogens.png
/usr/share/ghemical/2.10/user-docs/images/ribbon.png
/usr/share/ghemical/2.10/user-docs/images/sequence_builder.png
/usr/share/ghemical/2.10/user-docs/images/setup1.png
/usr/share/ghemical/2.10/user-docs/images/setup2.png
/usr/share/ghemical/2.10/user-docs/images/setup_select.png
/usr/share/ghemical/2.10/user-docs/images/toplevel.png
/usr/share/ghemical/2.10/user-docs/images/traj_dialog.png
/usr/share/ghemical/2.10/user-docs/images/using_mm_01.png
/usr/share/ghemical/2.10/user-docs/images/using_mm_02.png
/usr/share/ghemical/2.10/user-docs/images/using_mm_03.png
/usr/share/ghemical/2.10/user-docs/images/using_mm_04.png
/usr/share/ghemical/2.10/user-docs/images/using_mm_05.png
/usr/share/ghemical/2.10/user-docs/images/using_mm_06.png
/usr/share/ghemical/2.10/user-docs/images/using_mm_07.png
/usr/share/ghemical/2.10/user-docs/images/using_mm_08.png
/usr/share/ghemical/2.10/user-docs/images/using_mm_09.png
/usr/share/ghemical/2.10/user-docs/images/using_mm_10.png
/usr/share/ghemical/2.10/user-docs/images/using_mm_11.png
/usr/share/ghemical/2.10/user-docs/images/window.png
/usr/share/ghemical/2.10/user-docs/import_types.html
/usr/share/ghemical/2.10/user-docs/index.html
/usr/share/ghemical/2.10/user-docs/introduction.html
/usr/share/ghemical/2.10/user-docs/labels.html
/usr/share/ghemical/2.10/user-docs/measure.html
/usr/share/ghemical/2.10/user-docs/perspective.html
/usr/share/ghemical/2.10/user-docs/references.html
/usr/share/ghemical/2.10/user-docs/ribbon.html
/usr/share/ghemical/2.10/user-docs/sequence_builder.html
/usr/share/ghemical/2.10/user-docs/setup_dialog.html
/usr/share/ghemical/2.10/user-docs/using_mm.html
/usr/share/ghemical/2.10/user-docs/using_qm.html
/usr/share/ghemical/2.10/user-docs/using_sf.html
/usr/share/ghemical/2.10/user-docs/visualization.html
/usr/share/icons/ghemical.png
/usr/share/icons/large/ghemical.png
/usr/share/icons/mini/ghemical.png


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Fabrice Bellet, Wed Jan 10 02:13:51 2018