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Barnabas Poczos — most-cited papers & profile · AI for Science
← authors
·
overview
Barnabas Poczos
13
papers ·
131
citations ·
55
h-index
Carnegie Mellon University
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Most-cited papers
ChemBO: Bayesian Optimization of Small Organic Molecules with Synthesizable Recommendations
2019 · 39 citations
AmpLyze: A Deep Learning Model for Predicting the Hemolytic Concentration
2025 · 2 citations
Diffusion Models in $\textitDe Novo$ Drug Design
2024 · 1 citations
Objective-Agnostic Enhancement of Molecule Properties via Multi-Stage VAE
2023 · 1 citations
Pharmacophore-Conditioned Diffusion Model for Ligand-Based De Novo Drug Design
2025
Improving Molecule Properties Through 2-Stage VAE
2022
GraphBPE: Molecular Graphs Meet Byte-Pair Encoding
2024
Top co-authors
Chenghui Zhou
· 2
Newell Washburn
· 2
Amira Alakhdar
· 1
Amira Alakhdar
· 1
Eric P. Xing
· 1
Hanqi Feng
· 1
Jeff Schneider
· 1
Kirthevasan Kandasamy
· 1
Ksenia Korovina
· 1
Meng-Chun Zhang
· 1
Peng Qiu
· 1
Sailun Xu
· 1
Topics
Drug Discovery
Chemistry
Medical AI
Protein Science