AMBER Archive (2003)

Subject: Summary: mm_pbsa -- COMPT must be specified (correctly)

From: William Wei (william.wei_at_utoronto.ca)
Date: Tue Jan 14 2003 - 09:31:07 CST


Here I thank Drs Holger Gohlke, Mike Ford, and Martin for their attentions
and suggestions. Here is my problem:

>From Holger Gohlke:
The reason for your problem is - you
shouldn't have tab's between the keyword (say: COMPT) and the value
(say: ./Dimer.top) in the mm_pbsa.in file. The same also holds for the
@GB section.

I hope this get's you going

Holger