• Harmonic bond stretches: 45 out of 88 total parameters used. • Harmonic angle bending: 26 out of 40 total parameters used. • Proper torsions: 118 out of 167 total parameters used. For parameters not met in the training set, we used the default parameters from the Sage parameter library, hence further improvement in conformational energetics is likely possible through expansion of the training set. The benchmarking was performed using the workflow first described by Lim et al and the scripts and inputs required to repeat it can be found in the Supporting Data.