calculating energy term from extrabonds

From: Segun Jung (dauss75_at_gmail.com)
Date: Mon Feb 07 2011 - 23:50:43 CST

Dear all,

I have applied the extrabonds (only for a bond distance) as a 2D restraint
in my MD simulation, but when I look at a log file,
I do not see any energy term corresponding to the extrabonds. Could anyone
have ideas how to get the energy term?
It seemed it's been already calculated internally and added into the bond
energy, but I would like to see
the energy term separately.

Thanks,

Segun

This archive was generated by hypermail 2.1.6 : Mon Dec 31 2012 - 23:19:47 CST