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Acta Biomaterialia|February 20, 2025
Machine learning insights into calcium phosphate nucleation and aggregationJing Wang, Xin Wang, Dingguo XuPhysical Chemistry Chemical Physics : PCCP|August 2, 2022
Molecular investigations of the prenucleation mechanism of bone-like apatite assisted by type I collagen nanofibrils: insights into intrafibrillar mineralizationZhiyu Xue, Xin Wang, Dingguo XuPhysical Chemistry Chemical Physics : PCCP|May 3, 2022
Molecular dynamic simulation of prenucleation of apatite at a type I collagen template: ion association and mineralization controlZhiyu Xue, Xin Wang, Dingguo XuNanoscale|May 6, 2025
Structure prediction for nanoscale magic-size CdSe clusters from a new efficient structure-searching strategyGaolu Zhang, Xin Wang, Dingguo XuFrontiers in Chemistry|June 1, 2022
Exploring the Binding Mechanism of a Supramolecular Tweezer CLR01 to 14-3-3σ Protein <i>via</i> Well-Tempered MetadynamicsXin Zhou, Mingsong Shi, Xin Wang, et al.The Journal of Physical Chemistry. B|November 15, 2022
Molecular Dynamics Simulation of Biomimetic Biphasic Calcium Phosphate NanoparticlesQiao Zhang, Zhiyu Xue, Xin Wang, et al.Physical Chemistry Chemical Physics : PCCP|April 9, 2025
Molecular dynamics exploration of the barrier properties of small gas molecules in the semicrystalline parylene CShuo Li, Zhiyu Xue, Xin Wang, et al.Physical Chemistry Chemical Physics : PCCP|December 9, 2022
Processive binding mechanism of Cel9G from <i>Clostridium cellulovorans</i>: molecular dynamics and free energy landscape investigationsPenghui Li, Xin Wang, Chunchun Zhang, et al.Physical Chemistry Chemical Physics : PCCP|May 6, 2022
QM/MM investigation of the catalytic mechanism of processive endoglucanase Cel9G from <i>Clostridium cellulovorans</i>Penghui Li, Mingsong Shi, Xin Wang, et al.Journal of the Mechanical Behavior of Biomedical Materials|January 21, 2024
Effects of void defects on the mechanical properties of biphasic calcium phosphate nanoparticles: A molecular dynamics investigationQiao Zhang, Xin Wang, Mingli Yang, et al.Pageof 4,518