TD_datasets

Fragment Stability Benchmark
Fragmenter paper
OpenFF DANCE 1 eMolecules t142 v1.0
OpenFF Fragmenter Validation 1.0
OpenFF Full TorsionDrive Benchmark 1
OpenFF Gen 2 Torsion Set 1 Roche
OpenFF Gen 2 Torsion Set 1 Roche 2
OpenFF Gen 2 Torsion Set 2 Coverage
OpenFF Gen 2 Torsion Set 2 Coverage 2
OpenFF Gen 2 Torsion Set 3 Pfizer Discrepancy
OpenFF Gen 2 Torsion Set 3 Pfizer Discrepancy 2
OpenFF Gen 2 Torsion Set 4 eMolecules Discrepancy
OpenFF Gen 2 Torsion Set 4 eMolecules Discrepancy 2
OpenFF Gen 2 Torsion Set 5 Bayer
OpenFF Gen 2 Torsion Set 5 Bayer 2
OpenFF Gen 2 Torsion Set 6 Supplemental
OpenFF Gen 2 Torsion Set 6 Supplemental 2
OpenFF Group1 Torsions
OpenFF Group1 Torsions 2
OpenFF Group1 Torsions 3
OpenFF Primary Benchmark 1 Torsion Set
OpenFF Primary Benchmark 2 Torsion Set
OpenFF Primary TorsionDrive Benchmark 1
OpenFF Rowley Biaryl v1.0
OpenFF Substituted Phenyl Set 1
OpenFF-benchmark-ligand-fragments-v1.0
Pfizer Discrepancy Torsion Dataset 1
SMIRNOFF Coverage Torsion Set 1
SiliconTX Torsion Benchmark Set 1
TorsionDrive Paper