On Mon, Mar 08, 2010, Fernando Martín García wrote:
>
> 5. REFERENCE ATOM COORDINATES
>
>
> ----- READING GROUP 1; TITLE:
> DISANG= rsta1.dat
This should give you a clue: the program thinks "DISANG=rsta1.dat" is the
title of one of the constraint groups. I think the problem is the space
after the "=" sign: the parser is quite limited, and having such a space
is confusing it. See if that change will help.
...dac
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Received on Thu Mar 11 2010 - 08:00:04 PST
