topology file generation

From: Sanjeev B.S. <sanjeev_at_mbu.iisc.ernet.in>
Date: Mon 6 May 2002 11:06:36 +0530 (IST)

Hello,
        I would like to automate generation of topology file for a large
number of PDBs. Doing that LEaP (at least in amber6) does not
facilititate..., because user has to explicitly type at least one command
(to source a file). Is there any other way of doing it? Is there any other
way to redirect a file as input?

Thanks very much in advance for any information,
-Sanjeev
Received on Sun May 05 2002 - 22:36:36 PDT
Custom Search