ABCC : Application's document Page

catalyst At ABCC
Name: 
CATALYST
Version(s): 
4.11
Category: 
Molecular Modeling; Molecular Visualization
Author(s)/Vendor(s): 
Accelrys inc. 
9685 Scranton Road
San Diego, CA 92121-3752
Program Description: 
The Catalyst software provide drug design and discovery capabilities such as:
 - the generation of multiple conformations with extensive coverage of conformational space
 - pharmacophore-based alignment of molecules
 - shape-based three-dimensional database searching
 - automated generation of pharmacophore hypotheses based on SAR data

Catalyst also provides provides an integrated environment for database management and querying tasks.
Computer platform(s): 
SGI Irix
Linux (32-bit)
Location: 
/usr/local/fbscapp/accelrys/CAT411
Access: 
Account at ABCC is required to use Catalyst.

NCI scientists can also execute Catalyst directly on their SGI or Linux workstations 
via NFS filesystems with SGI and Linux applications that are provided by ABCC.

To run Catalyst:
 - add /usr/local/fbscapp/bin to your path such as with: 
   set path = ($path usr/local/fbscapp/bin)
 - start catalyst with: 
   RunA catalyst

If you do NOT want to use our startup script RunA: 
To start version 4.11:
source /usr/local/fbscapp/accelrys/cshrc_cat411
catalyst
Documentation: 
http://www.accelrys.com/doc/
Web Site: 
http://www.accelrys.com
ABCC Contact Person: 
S. Ravichandran
x1991 
Email: sravi@ncifcrf.gov
Created By: 


Created Time:



Updated By:

miaskiew


Updated Time:

2006-02-23





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