| { | |
| "bond_length_distribution": 1.0, | |
| "conformer_selection": 0.2152698902671228, | |
| "dihedral_scan": 0.690847375608493, | |
| "folding_stability": 0.5301666459052736, | |
| "reactivity": 0.24575411836844563, | |
| "ring_planarity": 1.0, | |
| "sampling": 0.8333333333333333, | |
| "reference_geometry_stability": 0.9562680738197924, | |
| "solvent_radial_distribution": 0.9366513166070168, | |
| "stability": 1.0, | |
| "tautomers": 0.1063542815425186, | |
| "water_radial_distribution": 0.9948542480547355, | |
| "overall_score": 0.6675558659166078, | |
| "noncovalent_interactions": 0.7362828393257764, | |
| "nudged_elastic_band": 0.1 | |
| } |