"protein binding sites" Papers

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BindGPT: A Scalable Framework for 3D Molecular Design via Language Modeling and Reinforcement Learning

Artem Zholus, Maksim Kuznetsov, Roman Schutski et al.

AAAI 2025paperarXiv:2406.03686
15
citations

Template-Guided 3D Molecular Pose Generation via Flow Matching and Differentiable Optimization

Noémie Bergues, Arthur Carré, Paul Join-Lambert et al.

NEURIPS 2025arXiv:2506.06305
2
citations