Zhaoxi Sun
Orcid: 0000-0001-8311-7797
According to our database1,
Zhaoxi Sun
authored at least 16 papers
between 2017 and 2023.
Collaborative distances:
Collaborative distances:
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Bibliography
2023
Screening Power of End-Point Free-Energy Calculations in Cucurbituril Host-Guest Systems.
J. Chem. Inf. Model., November, 2023
2022
Comprehensive evaluation of end-point free energy techniques in carboxylated-pillar[6]arene host-guest binding: I. Standard procedure.
J. Comput. Aided Mol. Des., 2022
Comprehensive evaluation of end-point free energy techniques in carboxylated-pillar[6]arene host-guest binding: II. regression and dielectric constant.
J. Comput. Aided Mol. Des., 2022
2021
Binding Thermodynamics and Interaction Patterns of Inhibitor-Major Urinary Protein-I Binding from Extensive Free-Energy Calculations: Benchmarking AMBER Force Fields.
J. Chem. Inf. Model., 2021
SAMPL7 TrimerTrip host-guest binding poses and binding affinities from spherical-coordinates-biased simulations.
J. Comput. Aided Mol. Des., 2021
Binding thermodynamics and interaction patterns of human purine nucleoside phosphorylase-inhibitor complexes from extensive free energy calculations.
J. Comput. Aided Mol. Des., 2021
SAMPL7 TrimerTrip host-guest binding affinities from extensive alchemical and end-point free energy calculations.
J. Comput. Aided Mol. Des., 2021
Clustering-based convergence diagnostic for multi-modal identification in parameter estimation of chromatography model with parallel MCMC.
CoRR, 2021
2020
SAMPL6 host-guest binding affinities and binding poses from spherical-coordinates-biased simulations.
J. Comput. Aided Mol. Des., 2020
Model-based process design of a ternary protein separation using multi-step gradient ion-exchange SMB chromatography.
Comput. Chem. Eng., 2020
2019
Determination of Base-Flipping Free-Energy Landscapes from Nonequilibrium Stratification.
J. Chem. Inf. Model., 2019
J. Comput. Chem., 2019
Model-based process design of a ternary protein separation using multi-step gradient ion-exchange SMB chromatography.
CoRR, 2019
2017
J. Chem. Inf. Model., August, 2017
Extensive Assessment of Various Computational Methods for Aspartate's p<i>K</i><sub>a</sub> Shift.
J. Chem. Inf. Model., July, 2017