Yanzi Zhou

发表

Molecular insight into chymotrypsin inhibitor 2 resisting proteolytic degradation.

D. Xie, Yani Chen, Wanqing Wei, 2019, Physical chemistry chemical physics : PCCP.

A new full-dimensional ab initio intermolecular potential energy surface and vibrational states for (HF)2 and (DF)2.

D. Xie, Dongzheng Yang, Yanzi Zhou, 2019, The Journal of chemical physics.

Solvent effect on concertedness of the transition state in the hydrolysis of p-nitrophenyl acetate.

Dingguo Xu, D. Xie, Yanzi Zhou, 2005, Organic letters.

Computational determination of binding modes of 2-acetoxyphenylhept-2-ynyl sulfide to cyclooxygenase-2

D. Xie, Jing Ma, Yani Chen, 2020, Journal of biomolecular structure & dynamics.

Mechanistic Insights into a Classic Wonder Drug—Aspirin

Yingkai Zhang, D. Xie, Yanzi Zhou, 2014, Journal of the American Chemical Society.

Base flipping free energy profiles for damaged and undamaged DNA.

S. Broyde, Yingkai Zhang, Shenglong Wang, 2010, Chemical research in toxicology.

Aging mechanism of soman inhibited acetylcholinesterase.

Yingkai Zhang, Shenglong Wang, Yanzi Zhou, 2012, The journal of physical chemistry. B.

Stimuli‐responsive hydrogels: Fabrication and biomedical applications

Junji Zhang, Yanzi Zhou, Ziyuan Li, 2021, VIEW.

A full-dimensional ab initio intermolecular potential energy surface and rovibrational spectra for OC-HF and OC-DF.

D. Xie, Yanzi Zhou, Jing Huang, 2021, The Journal of chemical physics.

A crosslinked colloidal network of peptide/nucleic base amphiphiles for targeted cancer cell encapsulation†

Yanyan Song, Junji Zhang, Junchen Wu, 2021, Chemical science.

A three-dimensional ab initio potential energy surface and predicted infrared spectra for the He-N2O complex.

Dong H. Zhang, D. Xie, Yanzi Zhou, 2006, The Journal of chemical physics.

A full-dimensional ab initio intermolecular potential energy surface and ro-vibrational spectra for N2-HF and N2-DF.

D. Xie, Yanzi Zhou, Jing Huang, 2020, The Journal of chemical physics.

Reaction mechanism of monoethanolamine with CO₂ in aqueous solution from molecular modeling.

Yingkai Zhang, Hong-Bin Xie, Yingkai Zhang, 2010, The journal of physical chemistry. A.

Amide Rotation Hindrance Predicts Proteolytic Resistance of Cystine-Knot Peptides.

Yingkai Zhang, D. Xie, Yanzi Zhou, 2016, Journal of Physical Chemistry Letters.

Linking inhibitor motions to proteolytic stability of sunflower trypsin inhibitor-1

D. Xie, Jing Ma, Wanqing Wei, 2019, RSC advances.

Serine protease acylation proceeds with a subtle re-orientation of the histidine ring at the tetrahedral intermediate.

Yingkai Zhang, Yanzi Zhou, 2011, Chemical communications.

A full-dimensional ab initio potential energy surface and rovibrational energies of the Ar–HF complex

D. Xie, Yanzi Zhou, Jing Huang, 2018 .

Catalytic reaction mechanism of acetylcholinesterase determined by Born-Oppenheimer ab initio QM/MM molecular dynamics simulations.

Yingkai Zhang, Shenglong Wang, Yanzi Zhou, 2010, The journal of physical chemistry. B.

Sirtuin Deacetylation Mechanism and Catalytic Role of the Dynamic Cofactor Binding Loop.

Yingkai Zhang, Shenglong Wang, Yawei Shi, 2013, The journal of physical chemistry letters.

Combined Molecular Dynamics and Coordinate Driving Method for Automatic Reaction Pathway Search of Reactions in Solution.

Daiqian Xie, Shuhua Li, Lijiang Yang, 2018, Journal of chemical theory and computation.

A new ab initio intermolecular potential energy surface and predicted rotational spectra of the Ne-H2S complex.

D. Xie, Yanzi Zhou, Jinping Lei, 2012, The Journal of chemical physics.

Potential energy surfaces and predicted infrared spectra for van der Waals complexes: dependence on one intramolecular vibrational coordinate

D. Xie, Yanzi Zhou, H. Ran, 2007 .

Five-dimensional ab initio potential energy surface and predicted infrared spectra of H2-CO2 van der Waals complexes.

D. Xie, Yanzi Zhou, H. Ran, 2007, The Journal of chemical physics.

A five-dimensional potential energy surface and predicted infrared spectra for the N2O-hydrogen complexes.

D. Xie, Yanzi Zhou, H. Ran, 2006, The Journal of chemical physics.

Three-dimensional ab initio potential-energy surface and rovibrational spectra of the H2-Kr complex.

D. Xie, Yanzi Zhou, 2005, The Journal of chemical physics.

Accelerated Quantum Mechanics/Molecular Mechanics Simulations via Neural Networks Incorporated with Mechanical Embedding Scheme.

D. Xie, Yanzi Zhou, Boyi Zhou, 2023, Journal of chemical theory and computation.

A full-dimensional ab initio intermolecular potential energy surface and dipole moment surfaces for H2O–Ar

D. Xie, Yanzi Zhou, Qiong Liu, 2022, Current Chinese Science.

Intermolecular potential energy surface and rovibrational spectra of the He-N2O complex from ab initio calculations.

D. Xie, Yanzi Zhou, 2004, The Journal of chemical physics.

Ab initio intermolecular potential-energy surface and microwave spectra for the Ne-OCS complex.

D. Xie, Yanzi Zhou, Hua Zhu, 2005, The Journal of chemical physics.

Predicted infrared spectra in the HF stretching band of the H2-HF complex.

D. Xie, Yanzi Zhou, Jing Huang, 2018, The Journal of chemical physics.

Security of Power Packet Dispatching Using Differential Chaos Shift Keying pdf

Takashi Hikihara, Ryo Takahashi, Yanzi Zhou, 2015, ArXiv.

Theoretical Study on the Rotational Spectra of Ar‐D232S Complex

D. Xie, Yanzi Zhou, Jinping Lei, 2013 .

Ab initio intermolecular potential energy surface, bound states, and microwave spectra for the van der Waals complex Ne-HCCCN.

D. Xie, Yanzi Zhou, 2005, The Journal of chemical physics.

Ab initio potential energy surface and rovibrational spectrum of Ar-HCCCN.

D. Xie, Yanzi Zhou, 2004, The Journal of chemical physics.

Active site cysteine is protonated in the PAD4 Michaelis complex: evidence from Born-Oppenheimer ab initio QM/MM molecular dynamics simulations.

Daiqian Xie, Yingkai Zhang, Shenglong Wang, 2009, The journal of physical chemistry. B.

Computational investigation on the binding modes of PET polymer to PETase.

D. Xie, Yanzi Zhou, Xuehui Guo, 2023, Journal of biomolecular structure & dynamics.

Full quantum scattering calculations of the line-shape parameters for the P and R branches of HF perturbed by Ar.

D. Xie, Dongzheng Yang, Yanzi Zhou, 2023, The Journal of chemical physics.

An internal water-retention site in the rhomboid intramembrane protease GlpG ensures catalytic efficiency.

S. Urban, Yingkai Zhang, Syed M. Moin, 2012, Structure.

Antibiotic binding to monozinc CphA beta-lactamase from Aeromonas hydropila: quantum mechanical/molecular mechanical and density functional theory studies.

Hua Guo, Daiqian Xie, Dingguo Xu, 2005, Journal of medicinal chemistry.