163 citations · 317 across the 9 of their papers we have counts for
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cs.LG2024★ 3 cited
AUTODIFF: Autoregressive Diffusion Modeling for Structure-based Drug Design
Xinze Li, Penglei Wang, Tianfan Fu +4
Structure-based drug design (SBDD), which aims to generate molecules that can bind tightly to the target protein, is an essential problem in drug discovery, and previous approaches…
physics.chem-ph2024
Revealing the Relationship Between Publication Bias and Chemical Reactivity with Contrastive Learning
Wenhao Gao, Priyanka Raghavan, Ron Shprints +1
A synthetic method's substrate tolerance and generality are often showcased in a "substrate scope" table. However, substrate selection exhibits a frequently discussed publication b…