firstbacksecondback
9 Results
|
Workshop
|
SE(3) Equivariant Topologies for Structure-based Drug Discovery Alvaro Prat · Roy Tal Dew · Hisham Aty · Aurimas Pabrinkis · Orestis Bastas · Tanya Paquet · Gintautas Kamuntavicius · Roy Tal |
||
|
Workshop
|
Constrained Multi-objective Bayesian Optimization Diantong Li · Fengxue Zhang · Chong Liu · Yuxin Chen |
||
|
Affinity Event
|
DrugAgent: A framework for drug discovery streamlined by an LLM Agent Anushka Shelke · Rohan Kumar · Agneev Ray · Parthiban Srinivasan |
||
|
Workshop
|
Sun 9:00 |
Multi scale modeling for drug discovery Animashree Anandkumar |
|
|
Workshop
|
Improving generalisability of 3D binding affinity models in low data regimes Julia Milena Buhmann · Ward Haddadin · Alan Bilsland · Lukáš Pravda · Hagen Triendl |
||
|
Workshop
|
GFlowNet Pretraining with Inexpensive Rewards Mohit Pandey · Gopeshh Subbaraj · Emmanuel Bengio |
||
|
Workshop
|
Sun 12:20 |
GFlowNet Pretraining with Inexpensive Rewards Mohit Pandey · Gopeshh Subbaraj · Emmanuel Bengio |
|
|
Workshop
|
Sun 14:15 |
Gap Between Theory and Practice in AI for Drug Discovery + Future Potentials of Foundational Models in Drug Discovery Ryan Peckner · Janet Paulsen · Bruno Trentini · Lindsay Edwards · Kyunghyun Cho |
|
|
Poster
|
Fri 11:00 |
WelQrate: Defining the Gold Standard in Small Molecule Drug Discovery Benchmarking Yunchao Liu · Ha Dong · Xin Wang · Rocco Moretti · Yu Wang · Zhaoqian Su · Jiawei Gu · Bobby Bodenheimer · Charles Weaver · Jens Meiler · Tyler Derr |