EDMolGPT generates drug-like molecules from low-resolution electron density point clouds of holo binding pockets and shows effectiveness across 101 biological targets.
Communications Chemistry , volume=
1 Pith paper cite this work. Polarity classification is still indexing.
1
Pith paper citing it
fields
cs.AI 1years
2026 1verdicts
UNVERDICTED 1representative citing papers
citing papers explorer
-
From Holo Pockets to Electron Density: GPT-style Drug Design with Density
EDMolGPT generates drug-like molecules from low-resolution electron density point clouds of holo binding pockets and shows effectiveness across 101 biological targets.