Hi,
Does anyone know the meaning of these codes from the output file of energy minimization ? Are they referring to protein atoms or is it the name of an energy minimization algorithm ?
HA
ND2
CG
CD
OG
OG1
HE2
CE
What about GMAX ? What does it mean ? I could not find these in the Amber 12 manual.
Regards
CONFIDENTIALITY:This email is intended solely for the person(s) named and may be confidential and/or privileged.If you are not the intended recipient,please delete it,notify us and do not copy,use,or disclose its content.
Towards A Sustainable Earth:Print Only When Necessary.Thank you.
_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Mon Jul 22 2013 - 00:30:02 PDT
