Dear all,
I was wondering if I can retrieve the atom coordinates (to .pdb file for example) after each cycle of the adsorption locator Monte Carlo runs. Currently I am only able to export the final structure when the Monte Carlo simulation finishes after several cycles. It would be nice if there's a method by which I can output the last frame of each cycle during the Monte Carlo simulation. Thanks for your help!
Cheers,
Hengyu