Dear Amber Users,
I am trying to create topology and coordinate files for the protein which
contains metal ion in it.
I am following MCPB.py bonded model tutorial.
While creating the topology and coordinates files I got an error, given
below
*home/guest/Documents/shilpa/software/amber18/bin/teLeap: Warning!Unknown
keyword (2C-Y2-M1) in parameter file. Perhaps a format issue?*
I have attached the tleap.in and tleap.out files, please find the attachment
Please help me to solve this issue.
Thanks in advance
Sincerely,
Shilpa T
_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Wed Sep 19 2018 - 03:00:02 PDT
