7 Jun
2005
7 Jun
'05
11:45 a.m.
I'm trying to find the command which corresponds to SET DYNAMIC_COULOMB = ON. It seems to me that it should be energy_data.dynamic_coulomb = True, but when I try this, my log shows DYNAMIC_PAIRS,_SPHERE,_COULOMB,_LENNARD,_MODELLER : T T F F T; I interpret this to mean that it is off.
When I use a top command file, I get: DYNAMIC_PAIRS,_SPHERE,_COULOMB,_LENNARD,_MODELLER : T T T F T indicating that it is on. How do I get this to happen using a Python file?
John Penniston