CGPLUS Home Page

CGPLUS-version 2008

Jingzhi Pu, Masahiro Higashi, Jiali Gao, and Donald G. Truhlar
Department of Chemistry and Supercomputing Institute
University of Minnesota, Minneapolis, Minnesota 55455

CGPLUS status:

Most recent version: 2008
Date of most recent version: April 28, 2008
Date of most recent manual update: April 28, 2008

CGPLUS-version 2008 description:

CGPLUS-recent revision history
CGPLUS-version 2008 abstract
CGPLUS-version 2008 manual in PDF format (546 KB)

CGPLUS is a package supporting the use of CHARMM and GAMESSPLUS as a
combination program. It contains utilities modifying CHARMM and GAMESSPLUS
to perform QM/MM calculations with the generalized hybrid orbital (GHO) boundary
treatment at the ab initio HF level (GHO-AIHF). The package is written in FORTRAN 77 with code for the CHARMM preprocessor.

The prospective user of the CHARMM/GAMESSPLUS combination package needs to obtain:
 

1. CHARMM-version c30a1
2. GAMESSPLUS-version 2008
3. CGPLUS-version 2008

A CHARMM license and the CHARMM program should be obtained from an academic or commercial CHARMM licenser.

GAMESSPLUS can be obtained from its home page: GAMESSPLUS Home Page

Availability

CGPLUS-version 2008 user or group license form
CGPLUS-version 2008 site license form
download CGPLUS-version 2008 from our Distribution Site

Links to other pages of interest:

Don Truhlar's Home Page
Jiali Gao's Home Page
GAMESSPLUS Home Page
CHARMM Home Page
Computational Chemistry at the University of Minnesota
Minnesota Supercomputing Institute
Department of Chemistry at the University of Minnesota