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Accurate Description of Solvent-Exposed Salt Bridges with a Non-polarizable Force Field Incorporating Solvent Effects.

H. Liu, H. Fu, C. Chipot, X. Shao, and W. Cai. J. Chem. Inf. Model., 62 (16): 3863-3873 (2022)

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Hua Shao

Li Shao

Hua Shao

Junyang Shao

Yaping Shao

Other publications of authors with the same name

Impact of different potentials on the structures and energies of clusters.Z. Ma, W. Cai, and X. Shao. J. Comput. Chem., 32 (14): 3075-3080 (2011)BFEE: A User-Friendly Graphical Interface Facilitating Absolute Binding Free-Energy Calculations.H. Fu, J. Gumbart, H. Chen, X. Shao, W. Cai, and C. Chipot. J. Chem. Inf. Model., 58 (3): 556-560 (2018)Hyperactive Antifreeze Proteins Promote Ice Growth before Binding to It.S. Cui, W. Zhang, X. Shao, and W. Cai. J. Chem. Inf. Model., 62 (21): 5165-5174 (2022)Continuous Wavelet Transform Applied to Removing the Fluctuating Background in Near-Infrared Spectra.C. Ma, and X. Shao. Journal of Chemical Information and Modeling, 44 (3): 907-911 (2004)Selecting significant genes by randomization test for cancer classification using gene expression data.Z. Mao, W. Cai, and X. Shao. J. Biomed. Informatics, 46 (4): 594-601 (2013)Explainable Graph Neural Networks with Data Augmentation for Predicting pKa of C-H Acids.H. An, X. Liu, W. Cai, and X. Shao. J. Chem. Inf. Model., 64 (7): 2383-2392 (2024)A dynamic lattice searching method for fast optimization of Lennard-Jones clusters.X. Shao, L. Cheng, and W. Cai. J. Comput. Chem., 25 (14): 1693-1698 (2004)MLCV: Bridging Machine-Learning-Based Dimensionality Reduction and Free-Energy Calculation.H. Chen, H. Liu, H. Feng, H. Fu, W. Cai, X. Shao, and C. Chipot. J. Chem. Inf. Model., 62 (1): 1-8 (2022)Finding an Optimal Pathway on a Multidimensional Free-Energy Landscape.H. Fu, H. Chen, X. Wang, H. Chai, X. Shao, W. Cai, and C. Chipot. J. Chem. Inf. Model., 60 (11): 5366-5374 (2020)Binding Thermodynamics of Fourth-Generation EGFR Inhibitors Revealed by Absolute Binding Free Energy Calculations.H. Zhou, H. Fu, X. Shao, and W. Cai. J. Chem. Inf. Model., 63 (24): 7837-7846 (December 2023)

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Disambiguation of "Shao, Xueguang"

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Accurate Description of Solvent-Exposed Salt Bridges with a Non-polarizable Force Field Incorporating Solvent Effects.

Please choose a person to relate this publication to

Hua Shao

Li Shao

Hua Shao

Junyang Shao

Yaping Shao

Other publications of authors with the same name

Disambiguation

BibSonomy

Disambiguation of "Shao, Xueguang"

copydeleteadd this publication to your clipboardcommunity posthistory of this postURLDOIBibTeXEndNoteAPAChicagoDIN 1505HarvardMSOffice XML Accurate Description of Solvent-Exposed Salt Bridges with a Non-polarizable Force Field Incorporating Solvent Effects.

Please choose a person to relate this publication to

Hua Shao

Li Shao

Hua Shao

Junyang Shao

Yaping Shao

Other publications of authors with the same name

Disambiguation

copy delete add this publication to your clipboard
community post
history of this post
URL
DOI
BibTeX
EndNote
APA
Chicago
DIN 1505
Harvard
MSOffice XML

Accurate Description of Solvent-Exposed Salt Bridges with a Non-polarizable Force Field Incorporating Solvent Effects.