Hi guys


I know that this is a list for questions about pymol but I need help in calculating energies from breaking and/or creating bonds. I’m new at this crystallography stuff so I don’t even know where to start looking for a program that could calculate these energies. I don’t know if pymol is capable of doing (I’m still learning on the cool things that pymol does) but if it does, can someone tell me how? Or does someone know where I can look for a program like that?


Thank you all for your information.




Teresa De la Mora Rey

Department of Biochemistry, Molecular Biology and Biophysics.

University of Minnesota

Lab: (612) 624-0141

"Never be afraid to try something new... remember amateurs built the Ark... professionals built the 'Titanic'".