Joseph A Morrone
10PUBLICATIONS
28CO-AUTHORS
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Publications (10)
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|Mar 04, 2026
In-Pocket 3D Graphs Enhance Ligand-Target Compatibility in Generative Small-Molecule Creation: A Dopamine D2 Receptor Model System.Seung-Gu Kang, Jeffrey K Weber, Joseph A Morrone
|Jan 28, 2026
Multi-View Biomedical Foundation Models for Molecule-Target and Property Prediction.Parthasarathy Suryanarayanan, Yunguang Qiu, Shreyans Sethi
|Jan 17, 2024
Unsupervised and supervised AI on molecular dynamics simulations reveals complex characteristics of HLA-A2-peptide immunogenicity.Jeffrey K Weber, Joseph A Morrone, Seung-Gu Kang
|Sep 16, 2022
Roughness of Molecular Property Landscapes and Its Impact on Modellability.Matteo Aldeghi, David E Graff, Nathan Frey
|Aug 08, 2022
Self-Focusing Virtual Screening with Active Design Space Pruning.David E Graff, Matteo Aldeghi, Joseph A Morrone
|Feb 07, 2022
Analysis of Training and Seed Bias in Small Molecules Generated with a Conditional Graph-Based Variational Autoencoder─Insights for Practical AI-Driven Molecule Generation.Seung-Gu Kang, Joseph A Morrone, Jeffrey K Weber
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Frequent Collaborators
2 joint publications
Seung-Gu Kang
2 joint publications
Matteo Aldeghi
2 joint publications
Edward O Pyzer-Knapp
2 joint publications
Connor W Coley
1 joint publications
Shulin Zhuang
1 joint publications
Weiping Liu
1 joint publications
Ruhong Zhou
1 joint publications
Heng Luo
1 joint publications
Nathan Frey
1 joint publications
Jeffrey K Weber
