An evaluation of five unconditional 3D molecular generators finds that standard saturated benchmarks overstate quality, and that post-processing changes the model ranking.
Deep generative models for 3D molecular structure
1 Pith paper cite this work. Polarity classification is still indexing.
1
Pith paper citing it
fields
physics.chem-ph 1years
2025 1verdicts
CONDITIONAL 1representative citing papers
citing papers explorer
-
An evaluation of unconditional 3D molecular generation methods
An evaluation of five unconditional 3D molecular generators finds that standard saturated benchmarks overstate quality, and that post-processing changes the model ranking.