Subject: Re: CCL:Gaussian 98 benchmark for PC systems

From: Malcolm Gillies <[email-masked]>
Date: Tue, 11 Dec 2001 10:11:50 +0100

> 	We have got the information from Gaussian Inc. that distributing the
> modified version of makefile or the instructions is violation to the licence
> agreement.

Maybe I'm being obtuse, but posting a patch (i.e. a diff) to the Gaussian
makefile would seem the obvious solution. This way you do not have to
distribute the Gaussian-licensed code.

There is a patch available to make g98 compile with the g77 compiler,
for instance:

    http://quanta.synchem.kyoto-u.ac.jp/~maho/Computer/Linux_gaussian_e.html

Preparing the patch is just a matter of

    diff -c makefile.old makefile.new >g98.patch

or something similar...

cheers,

Malcolm
--
Malcolm Gillies <[email-masked]>
Post-doctoral researcher
Organic Chemistry, Dept Chemistry,
Technical University of Denmark