Dear all
I am using tleap and AMBER14SB force filed for my protein. In the leap log I have a lot of lines with warnings for two improper dihedrals involving the N3 atoms
** Warning: No sp2 improper torsion term for C8-H-N3-H
atoms are: CE HZ2 NZ HZ3
** Warning: No sp2 improper torsion term for H-H-N3-H
atoms are: HZ1 HZ2 NZ HZ3
It is safe to ignore them and continue ?
Thanks in advance
Stéphane
----------------------------------------------------------
Stéphane Abel, Ph.D., HDR
CEA Centre de Saclay
DRF/JOLIOT/I2BC-S/SB2SM/LBMS
Bat 528, Office 138C
Gif-sur-Yvette, F-91191 FRANCE
Phone (portable) : +33 6 49 37 70 60
_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Wed Nov 10 2021 - 06:30:02 PST
