On Mon, Jun 24, 2013 at 8:46 AM, Vaibhav Dixit <vaibhavadixit.gmail.com>wrote:
> Hi, I had this problem with Amber12, which was solved by making sure that
> the ligand ID is included in the "print_res" option.
> Do let me know if you have solved it in some other way. Thanks.
>
Oh yes! I remember this (
http://archive.ambermd.org/201302/0334.html <-
there is the thread). Thanks for the reminder. This problem is definitely
present here (hopefully it is the only issue). I will add a check for this
so there is a helpful error message. Please add residue 561 to the list
of printed residues in the decomp section and try running again.
In the meantime, I will fix this.
Thanks!
Jason
--
Jason M. Swails
Quantum Theory Project,
University of Florida
Ph.D. Candidate
352-392-4032
_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Mon Jun 24 2013 - 07:00:02 PDT
