AMBER Archive (2002)

Subject: mopac

From: David.Rilett_at_astrazeneca.com
Date: Thu Jun 27 2002 - 12:50:41 CDT

There is a mopac.sh in amber7 that points to /usr/local/mopac (mopac not
there).

I have tried changing path to our tripos and Accelrys mopac dirs with no
affect (fails antechamber test).

May assume the following?

1. there is no bug in the test
2. there is no mopac included in the Amber 6 or 7 dists.
3. mopac exes mentioned are optimised or otherwise unusable.
4. we need to obtain a mopac license for a standalone to use antechamber.
5. the mopac license is free

Thanks,

David G. Rilett
UNIX/IRIX Systems Consultant
Astrazeneca R&D Boston, MA
Phone: 1-781-839-4644
Pager: 1-781-765-7136
...............