Fitting Data and Results
Fitting targets: 2nd generation training sets (link for the details of the training set generation scheme: http://doi.org/10.5281/zenodo.3777278)
Input force field : version 1.1.0 parsley (http://doi.org/10.5281/zenodo.3695094)
The objective function decreased from
8.70968e+03
to?
in ? steps.