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Sponsored Artificial Intelligence: A Modern Approach, Global Edition Artificial Intelligence: A Modern Approach, Global Edition

Author

Zhihua Tian

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Book Open access Aug 2026

PRIME: A Pretrained Representation-Induced Model for 3D Molecules in De Novo Binder Design

Biomolecular binder design for peptides and antibodies requires generating diverse candidates that satisfy stringent three-dimensional geometric constraints while enabling affinity-oriented exploration under strong structural priors. In current generative models, the effective search space for structurally feasible bin...

Zhihua Tian, Jia-Le Zhou, Ru-Bo Wang et al. · 0 citations
Book Open access Aug 2026

PRIME: A Pretrained Representation-Induced Model for 3D Molecules in De Novo Binder Design

Semantics-Preserving Exploratory Sampling (SPES), which integrates Graph Laplacian Spectral Noise to respect chain connectivity and Conditional Freedom Modulation to dynamically balance exploration with fidelity, enables diversity-enhanced generation without sacrificing geometric validity under the reported structural...

Zhihua Tian, Jiale Zhou, Rubo Wang et al. · 0 citations

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