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Han Liu

6PUBLICATIONS
7CO-AUTHORS
Deep learningNon-Newtonian fluid flows (incl. rheology)Transport properties and non-equilibrium processesStatistical mechanics in chemistryBiomolecular modelling and design
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Journal

Publications (6)

Sort by Publication Date:
|Nov 10, 2023
Deep-Learning-Assisted Enhanced Sampling for Exploring Molecular Conformational Changes.

Haohao Fu, Han Liu, Jingya Xing

|Dec 13, 2022
Revealing the Mechanism of Irreversible Binding of Antifreeze Glycoproteins to Ice.

Weijia Zhang, Han Liu, Haohao Fu

|Aug 03, 2022
Accurate Description of Solvent-Exposed Salt Bridges with a Non-polarizable Force Field Incorporating Solvent Effects.

Han Liu, Haohao Fu, Christophe Chipot

|Dec 23, 2021
MLCV: Bridging Machine-Learning-Based Dimensionality Reduction and Free-Energy Calculation.

Haochuan Chen, Han Liu, Heying Feng

|Jun 14, 2021
Accuracy of Alternate Nonpolarizable Force Fields for the Determination of Protein-Ligand Binding Affinities Dominated by Cation-π Interactions.

Han Liu, Haohao Fu, Christophe Chipot

|Aug 28, 2020
Accurate Description of Cation-π Interactions in Proteins with a Nonpolarizable Force Field at No Additional Cost.

Han Liu, Haohao Fu, Xueguang Shao

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Frequent Collaborators

6 joint publications

Xueguang Shao

6 joint publications

Wensheng Cai

5 joint publications

Haohao Fu

4 joint publications

Christophe Chipot

1 joint publications

Haochuan Chen

1 joint publications

Weijia Zhang

1 joint publications

Jingya Xing

Frequent Collaborators

6 joint publications

Xueguang Shao

6 joint publications

Wensheng Cai

5 joint publications

Haohao Fu

4 joint publications

Christophe Chipot

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