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Workshop
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In vitro validated antibody design against multiple therapeutic antigens using generative inverse folding
Amir Shanehsazzadeh
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Workshop
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In vitro validated antibody design against multiple therapeutic antigens using generative inverse folding
Amir Shanehsazzadeh
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Workshop
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In vitro validated antibody design against multiple therapeutic antigens using generative inverse folding
Amir Shanehsazzadeh
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Workshop
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Binding Oracle: Fine-Tuning From Stability to Binding Free Energy
Chengyue Gong · Adam Klivans · Jordan Wells · James Loy · Qiang Liu · Alex Dimakis · Daniel Diaz
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Poster
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Wed 8:45
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FABind: Fast and Accurate Protein-Ligand Binding
Qizhi Pei · Kaiyuan Gao · Lijun Wu · Jinhua Zhu · Yingce Xia · Shufang Xie · Tao Qin · Kun He · Tie-Yan Liu · Rui Yan
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Workshop
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CoarsenConf: Equivariant Coarsening with Aggregated Attention for Molecular Conformer Generation
Danny Reidenbach · Aditi Krishnapriyan
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Poster
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Tue 15:15
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Unsupervised Protein-Ligand Binding Energy Prediction via Neural Euler's Rotation Equation
Wengong Jin · Siranush Sarkizova · Xun Chen · Nir HaCohen · Caroline Uhler
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Workshop
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DSMBind: an unsupervised generative modeling framework for binding energy prediction
Wengong Jin · Caroline Uhler · Nir HaCohen
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Workshop
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TrustAffinity: accurate, reliable and scalable out-of-distribution protein-ligand binding affinity prediction using trustworthy deep learning
Amitesh Badkul · Li Xie · Shuo Zhang · Lei Xie
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Workshop
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The Discovery of Binding Modes Requires Rethinking Docking Generalization
Gabriele Corso · Arthur Deng · Nicholas Polizzi · Regina Barzilay · Tommi Jaakkola
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Workshop
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Sat 7:30
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Contributed talk | The Discovery of Binding Modes Requires Rethinking Docking Generalization
Gabriele Corso · Arthur Deng · Nicholas Polizzi · Regina Barzilay · Tommi Jaakkola
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Workshop
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Harmonic Prior Self-conditioned Flow Matching for Multi-Ligand Docking and Binding Site Design
Hannes Stärk · Bowen Jing · Regina Barzilay · Tommi Jaakkola
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