Zhengdan Zhu

6PUBLICATIONS
9CO-AUTHORS
Bioinformatic methods developmentBiomolecular modelling and designOrganometallic chemistryMolecular medicine
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Publications (6)

|Sep 27, 2024
Bridging Machine Learning and Thermodynamics for Accurate pK a Prediction.

Weiliang Luo, Gengmo Zhou, Zhengdan Zhu

|May 01, 2023
Uni-Dock: GPU-Accelerated Docking Enables Ultralarge Virtual Screening.

Yuejiang Yu, Chun Cai, Jiayue Wang

|Dec 01, 2020
Substitution Effect of the Trifluoromethyl Group on the Bioactivity in Medicinal Chemistry: Statistical Analysis and Energy Calculations.

Amina Abula, Zhijian Xu, Zhengdan Zhu

|May 27, 2020
Interaction Nature and Computational Methods for Halogen Bonding: A Perspective.

Zhengdan Zhu, Zhijian Xu, Weiliang Zhu

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