pkg-descr

Visualizing the results of molecular orbital calculations
1) MO program: gaussian, gamess, mopac, etc.
2) display molecule in 3D: geo-opt, single-point, nomal mode (animation)
3) density: contour plot or 3D view for electron density and MO coefficient
Everything what you want about MO calculation can be seen.

WWW: http://www.cmbi.kun.nl/~schaft/molden/molden.html

By the distribution policy of the author;
* Only the latest version is supplied.
* Users must get the `distfiles' from the original site.
* Do not re-distribute the source and the executable.
* Using a not-so-latest version is prohibited, because
the author may only respond about the latest version.

--
rmiya

pkg-plist

bin/ambfor
bin/gmolden
bin/molden
bin/surf
%%PORTDOCS%%%%DOCSDIR%%/manual.txt.Z
%%PORTDOCS%%%%DOCSDIR%%/manual.ps.Z
%%PORTDOCS%%%%DOCSDIR%%/figures.ps.Z
%%PORTDATA%%%%DATADIR%%/test/adf.molf
%%PORTDATA%%%%DATADIR%%/test/ambfor_amber.xyz
%%PORTDATA%%%%DATADIR%%/test/ambfor_gaff.xyz
%%PORTDATA%%%%DATADIR%%/test/ampac.arc
%%PORTDATA%%%%DATADIR%%/test/ampac.test
%%PORTDATA%%%%DATADIR%%/test/bucky.xyz
%%PORTDATA%%%%DATADIR%%/test/chemx.test
%%PORTDATA%%%%DATADIR%%/test/complex2.out
%%PORTDATA%%%%DATADIR%%/test/cpeptide.gro
%%PORTDATA%%%%DATADIR%%/test/esp.test
%%PORTDATA%%%%DATADIR%%/test/esp.txt
%%PORTDATA%%%%DATADIR%%/test/esp.xyz
%%PORTDATA%%%%DATADIR%%/test/fragment
%%PORTDATA%%%%DATADIR%%/test/gamess_uk.freq
%%PORTDATA%%%%DATADIR%%/test/gamess_uk.input
%%PORTDATA%%%%DATADIR%%/test/gamess_uk.test1
%%PORTDATA%%%%DATADIR%%/test/gamess_uk.test2
%%PORTDATA%%%%DATADIR%%/test/gamess_us.h2o_631g_opt.out
%%PORTDATA%%%%DATADIR%%/test/gamess_us.irc
%%PORTDATA%%%%DATADIR%%/test/gamess_us_uhf_opt
%%PORTDATA%%%%DATADIR%%/test/gaussian.freq
%%PORTDATA%%%%DATADIR%%/test/gaussian.input
%%PORTDATA%%%%DATADIR%%/test/gaussian.test
%%PORTDATA%%%%DATADIR%%/test/jaguar.cube
%%PORTDATA%%%%DATADIR%%/test/molden.ogl
%%PORTDATA%%%%DATADIR%%/test/mopac.freq
%%PORTDATA%%%%DATADIR%%/test/mopac.test
%%PORTDATA%%%%DATADIR%%/test/pdb.test
%%PORTDATA%%%%DATADIR%%/test/pdb.test.omap
%%PORTDATA%%%%DATADIR%%/test/qchem.test
%%PORTDATA%%%%DATADIR%%/test/reacpth.xyz
%%PORTDATA%%%%DATADIR%%/test/shelx.ins
%%PORTDATA%%%%DATADIR%%/test/surface.molf
%%PORTDATA%%%%DATADIR%%/test/test.fdat
%%PORTDATA%%%%DATADIR%%/test/test.mol2
%%PORTDATA%%%%DATADIR%%/test/test_homo.cube
%%PORTDATA%%%%DATADIR%%/test/tinker_charmm.xyz
%%PORTDATA%%%%DATADIR%%/test/tinker_mm3.xyz
%%PORTDATA%%%%DATADIR%%/test/uracil.fdat
%%PORTDATA%%%%DATADIR%%/test/uracil_gauss.out
%%PORTDATA%%%%DATADIR%%/test/vamp.test
%%PORTDATA%%%%DATADIR%%/utils/INFO
%%PORTDATA%%%%DATADIR%%/utils/ch_backspace
%%PORTDATA%%%%DATADIR%%/utils/ch_mxcon
%%PORTDATA%%%%DATADIR%%/utils/ch_par
%%PORTDATA%%%%DATADIR%%/utils/colors
%%PORTDATA%%%%DATADIR%%/utils/ircextract.awk
%%PORTDATA%%%%DATADIR%%/utils/molden
%%PORTDATA%%%%DATADIR%%/utils/multi_vrml.csh
%%PORTDATA%%%%DATADIR%%/utils/multi_vrml_orbitals.csh
%%PORTDATA%%@dirrm %%DATADIR%%/utils
%%PORTDATA%%@dirrm %%DATADIR%%/test
%%PORTDATA%%@dirrm %%DATADIR%%