
7 Apr
2011
7 Apr
'11
2:58 a.m.
Dear Chimera Dev. Team, I have a problem when I'm trying to launch "minimize" in the Python IDLE. If I write in the IDLE:
import MMMD
MMMD.base.Minimizer(chimera.openModels.list(modelTypes=[chimera.Molecule]),nsteps=0)
I get (in the IDLE): <MMMD.base.Minimizer instance at 0x9e0978c> But if I write in the command line: minimize nsteps 0 I get (in the IDLE and in the message bar):
Initial energy: 475.211926
Anybody has any idea about that? Kind regards. Elisabeth Ortega - Carrasco Ph.D. Student @ Universitat Autònoma de Barcelona