Kecheng Yang

6PUBLICATIONS
7CO-AUTHORS
Cheminformatics and quantitative structure-activity relationshipsCharacterisation of biological macromoleculesBiomolecular modelling and designProteins and peptides
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Publications (6)

|Jun 11, 2026
Co-Folding-Driven Structural Mapping of Reversible LSD1 Inhibitors Reveals Unexplored Chemical Space and Binding Diversity.

|May 16, 2025
Unveiling New Binding Sites and Allosteric Regulation Mechanisms of LSD1 for Novel Therapeutics.

Kecheng Yang, Jinbo Xiong, Yuting Shi

|Mar 31, 2025
Drug-Target Affinity Prediction Based on Topological Enhanced Graph Neural Networks.

Hengliang Guo, Congxiang Zhang, Jiandong Shang

|Jun 05, 2024
Mining the Dynamical Properties of Substrate and FAD Binding Pockets of LSD1: Hints for New Inhibitor Design Direction.

Kecheng Yang, Hongmin Liu

|Dec 27, 2023
Uncovering New Conformational States of the Substrate Binding Pocket of LSD1 Potential for Inhibitor Design via Funnel Metadynamics.

Kecheng Yang, Hongmin Liu

|May 19, 2023
Discovery of Novel 1,3-Diphenylpyrazine Derivatives as Potent S-Phase Kinase-Associated Protein 2 (Skp2) Inhibitors for the Treatment of Cancer.

Kun Zhang, Kaizhao Hu, Qian Li

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Frequent Collaborators

2 joint publications

Hongmin Liu

1 joint publications

Bing Zhao

1 joint publications

Hengliang Guo

1 joint publications

Congxiang Zhang