[gmx-users] .top file format

Mark Abraham Mark.Abraham at anu.edu.au
Sat Apr 8 04:19:13 CEST 2006

Ashutosh Jogalekar wrote:
> I have a simple question; is the .top file a formatted file?
> I am trying to put in some RB dihedral parameters in the file for an  
> unnatural acid. My question is; does the exact spacing of the lines  
> matter?

Where the documentation in chapter 5 talks about needing information on 
separate lines, I would expect it does matter. Otherwise, you'd have to 
try it an see, or read the code, or get an opinion from someone who has 
read the code!


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