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Workshop
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DiffDock: Diffusion Steps, Twists, and Turns for Molecular Docking
Gabriele Corso · Hannes Stärk · Bowen Jing · Regina Barzilay · Tommi Jaakkola
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Workshop
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Dynamic-backbone protein-ligand structure prediction with multiscale generative diffusion models
Zhuoran Qiao · Weili Nie · Arash Vahdat · Thomas Miller · Anima Anandkumar
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Workshop
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Sat 9:00
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Dynamic-backbone protein-ligand structure prediction with multiscale generative diffusion models
Zhuoran Qiao · Weili Nie · Arash Vahdat · Thomas Miller · Anima Anandkumar
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Poster
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TANKBind: Trigonometry-Aware Neural NetworKs for Drug-Protein Binding Structure Prediction
Wei Lu · Qifeng Wu · Jixian Zhang · Jiahua Rao · Chengtao Li · Shuangjia Zheng
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Workshop
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Ligand-aware protein sequence design using protein self contacts
Jody Mou · Benjamin Fry · Chun-Chen Yao · Nicholas Polizzi
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Workshop
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T-cell receptor specific protein language model for prediction and interpretation of epitope binding (ProtLM.TCR)
Ahmed Essaghir
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Workshop
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Predicting Ligand – RNA Binding Using E3-Equivariant Network and Pretraining
Zhenfeng Deng · Ruichu Gu · Hangrui Bi · Xinyan Wang · Zhaolei Zhang · Han Wen
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Workshop
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Sat 11:40
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Predicting Ligand – RNA Binding Using E3-Equivariant Network and Pretraining
Zhenfeng Deng · Ruichu Gu · Hangrui Bi · Xinyan Wang · Zhaolei Zhang · Han Wen
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Workshop
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APPRAISE: ranking engineered proteins by target binding propensity using pair-wise, competitive structure modeling and physics-informed analysis
Xiaozhe Ding · Xinhong Chen · Erin Sullivan · Tim Miles · Viviana Gradinaru
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