most citedDTIAM: A unified framework for predicting drug-target interactions, binding affinities and activation/inhibition mechanisms

1 citations · 1 across the 2 of their papers we have counts for

collaborators
Showing cs.LGShow all

1 paper · 1 filter

cs.LG2025

ActivityDiff: A diffusion model with Positive and Negative Activity Guidance for De Novo Drug Design

Renyi Zhou, Huimin Zhu, Jing Tang +1

Achieving precise control over a molecule's biological activity-encompassing targeted activation/inhibition, cooperative multi-target modulation, and off-target toxicity mitigation…