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sm-spell-submit - Re: [SM-Spell-Submit]New spell [ section: [science | z-rejected] ]molden

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Subject: Submit list for new spells

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  • From: "Ryan Abrams" <ryan.abrams AT attbi.com>
  • To: "Yoav Avitzour" <avitzour AT princeton.edu>, <eric AT sandall.us>
  • Cc: "Source Mage Spell Submit" <sm-spell-submit AT lists.ibiblio.org>, <Geoffrey.Derber AT Trinity.edu>
  • Subject: Re: [SM-Spell-Submit]New spell [ section: [science | z-rejected] ]molden
  • Date: Thu, 22 Aug 2002 11:48:29 -0500

Free = Free as in freedom.

Free for non commercial use = Non-Free.

z-rejected.

Soon we will be able to have an entire non-free grimoire, and this wont be
as much of an issue.

-Ryan
----- Original Message -----
From: "Yoav Avitzour" <avitzour AT princeton.edu>
To: <eric AT sandall.us>
Cc: "Source Mage Spell Submit" <sm-spell-submit AT lists.ibiblio.org>;
<Geoffrey.Derber AT Trinity.edu>; <ryan.abrams AT attbi.com>
Sent: Thursday, August 22, 2002 11:36 AM
Subject: Re: [SM-Spell-Submit]New spell [ section: [science |
z-rejected] ]molden


> I don't know what is our policy regarding that. Ryan ?
>
> On Mon, 2002-08-19 at 19:20, Eric Sandall wrote:
> > Free for non-commercial use, hence my z-rejected mention.
> >
> > Molden is a package for displaying Molecular Density from the Ab Initio
> > packages GAMESS-UK , GAMESS-US and GAUSSIAN and the Semi-Empirical
> > packages Mopac/Ampac, it also supports a number of other programs via
the
> > Molden Format. Molden reads all the required information from the GAMESS
/
> > GAUSSIAN outputfile. Molden is capable of displaying Molecular Orbitals,
> > the electron density and the Molecular minus Atomic density. Either the
> > spherically averaged atomic density or the oriented ground state atomic
> > density can be subtracted for a number of standard basis sets. Molden
> > supports contour plots, 3-d grid plots with hidden lines and a
combination
> > of both. It can write a variety of graphics instructions; postscript,
> > XWindows, VRML, povray, OpenGL, tekronix4014, hpgl, hp2392 and Figure.
The
> > Xwindows version of Molden is also capable of importing and displaying
of
> > chemx, PDB, and a variety of mopac/ampac files and lots of other
formats.
> > It also can animate reaction paths and molecular vibrations. It can
> > calculate and display the true or Multipole Derived Electrostatic
> > Potential and atomic charges can be fitted to the Electrostatic
Potential
> > calculated on a Connolly surface. Molden has a powerful Z-matrix editor
> > which give full control over the geometry and allows you to build
> > molecules from scratch, including polypeptides. Molden was also
submitted
> > to the QCPE (QCPE619), allthough the Xwindows version is considerably
> > running behind on the current one.
> >
> > -One of Three
> >
> > --
> > Eric Sandall | Source Mage GNU/Linux Developer
> > eric AT sandall.us | http://www.sourcemage.org
> > http://www.sandall.us/~sandalle | SysAdmin @ Inst. Shock Physics @ WSU
> > ICQ: 667348 | http://www.shock.wsu.edu/
> >
>





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