This just removes the WAT strings. This is ok, but just it would be nice not to have more than 10000 of TER in the file after this. maybe it s posible to strip waters from .rst file and then convert it to PDB.
22.08.09, 19:45, "Bill Ross" :
> > is it possible to strip water from .rst file just by ambpdb command
> > directly from .rst file?
>
> If you want a pdb, generate it then
>
> % egrep -v WAT first.pdb > dry.pdb
>
> Bill
>
> _______________________________________________
> AMBER mailing list
> AMBER.ambermd.org
> http://lists.ambermd.org/mailman/listinfo/amber
>
>
_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Sun Dec 06 2009 - 12:00:02 PST