Yanyan Zhu

发表

Evaluations of AMBER force field parameters by MINA approach for copper-based nucleases

Chunmei Liu, Bin Zhang, Yanyan Zhu, 2016, Structural Chemistry.

Pincer iridium(III)-catalyzed enantioselective C(sp3)-H functionalization via carbenoid C-H insertion of 3-diazooxindoles with 1,4-cyclohexadiene

Nan Li, Yanyan Zhu, Mao‐Ping Song, 2021, Chinese Chemical Letters.

Molecular recognition of cyclodecapeptides to ibuprofen and naproxen enantiomers: a theoretical study

Wenjing Zhang, Chunmei Liu, Yanyan Zhu, 2017, Structural Chemistry.

Mechanisms and stereoselectivities of the Rh(I)-catalyzed carbenoid carbon insertion reaction of benzocyclobutenol with diazoester.

D. Wei, Wenjing Zhang, Yang Wang, 2015, Organic & biomolecular chemistry.

Theoretical investigations of the Ir-catalyzed direct borylation of B(3,6)–H of o-carborane: the actual catalyst, mechanism, and origin of regioselectivity

Hao Xu, D. Wei, Wenjing Zhang, 2018 .

A DFT study on N-heterocyclic carbene catalyzed [4+2] annulation reaction with in situ generated heterocyclic ortho-quinodimethane: Mechanism, origin of enantioselectivity and role of catalyst

Hao Xu, Wenjing Zhang, Chunmei Liu, 2018 .

A DFT study on the competing mechanisms of PPh3-catalyzed (3 + 3) and (3 + 2) annulations between 5-acetoxypenta-2,3-dienoate and 1C,3O-bisnucleophiles

D. Wei, Shijun Li, D. Fang, 2015 .

Theoretical investigations toward the [4 + 2] cycloaddition of ketenes with N-benzoyldiazenes catalyzed by N-heterocyclic carbenes: mechanism and enantioselectivity.

D. Wei, Wenjing Zhang, Yanyan Zhu, 2012, The Journal of organic chemistry.

Understanding theZselectivity of the metal-free intermolecular aminoarylation of alkynes: a DFT study

D. Wei, Shijun Li, Wenjing Zhang, 2019, Organic Chemistry Frontiers.

New mechanistic insight into stepwise metal-center exchange in a metal-organic framework based on asymmetric Zn(4) clusters.

H. Hou, Yaoting Fan, Wei-Wei Meng, 2014, Chemistry.

Systematic study of the luminescent europium-based nonanuclear clusters with modified 2-hydroxybenzophenone ligands.

Bin Zhang, Chunmei Liu, Yanyan Zhu, 2013, Inorganic chemistry.

1,8-naphthyridine-derived Ni(2+)/Cu(2+)-selective fluorescent chemosensor with different charge transfer processses.

Mingming Yu, Zhanxian Li, Liuhe Wei, 2012, Inorganic chemistry.

A DFT study on the reaction mechanism of dimerization of methyl methacrylate catalyzed by N-heterocyclic carbene.

Ying Ran, D. Wei, Wenjing Zhang, 2014, Physical chemistry chemical physics : PCCP.

Theoretical study of binding affinity for diamidine with DNA

D. Wei, Wenjing Zhang, Chunmei Liu, 2016, Structural Chemistry.

A density functional theory study on lewis acid‐catalyzed transesterification of β‐oxodithioesters

D. Wei, Yanyan Zhu, M. Tang, 2014 .

DFT study on the mechanisms and diastereoselectivities of Lewis acid-promoted ketene-alkene [2 + 2] cycloadditions: what is the role of Lewis acid in the ketene and C = X (X = O, CH₂, and NH) [2 + 2] cycloaddition reactions?

D. Wei, Yang Wang, Yanyan Zhu, 2014, The journal of physical chemistry. A.

A computational study on the reaction mechanisms of N-formylation of amines under a Lewis acid catalysis

D. Wei, Cheng-xing Cui, Yanyan Zhu, 2010 .

A DFT study on the reaction mechanisms of ketene–ketone [2 + 2 + 2] cycloaddition to form 3-aryglutaric anhydrides under a Lewis acid catalysis: What is the role of BF3?

D. Wei, Wenjing Zhang, Yanyan Zhu, 2010 .

A platinum(II) complex bearing deprotonated 2-(diphenylphosphino)benzoic acid for superior phosphorescence of monomers.

Bin Zhang, Chunmei Liu, Yanyan Zhu, 2014, Dalton transactions.

Four novel frameworks built by imidazole-based dicarboxylate ligands: hydro(solvo)thermal synthesis, crystal structures, and properties.

Yanyan Zhu, Zifeng Li, Gang Li, 2010, Inorganic chemistry.

DFT study on reaction mechanisms of propylamine and dimethyl acetylenedicarboxylate with 1,3-dimethylalloxan

Wenjing Zhang, Yanyan Zhu, M. Tang, 2013 .

Construction of a series of coordination polymers from three imidazole-based multi-carboxylate ligands.

Gang Li, Yang-Guang Wang, Yanyan Zhu, 2013, Dalton transactions.

Construction of transition-metal coordination polymers using multifunctional imidazole dicarboxylates as spacers

Yanyan Zhu, Gang Li, B. Shi, 2013 .

Design and construction of six metal–organic frameworks with 2-p-methoxyphenyl-1H-imidazole-4,5-dicarboxylate

Yanyan Zhu, Gang Li, Jun Zhang, 2012 .

One Chiral and Two Achiral 3-D Coordination Polymers Constructed by 2-Phenyl Imidazole Dicarboxylate

Yanyan Zhu, M. Tang, Gang Li, 2010 .

Construction of Zn(II)-ferrocenyl carboxylate coordination complexes via changing adjuvant ligands

H. Hou, Shaomin Wang, Yue-Xin Guo, 2012 .

Benzylation of Arenes with Benzyl Halides under Promoter-Free and Additive-Free Conditions

Yunlai Ren, Yanyan Zhu, Xin Cheng, 2019, European Journal of Organic Chemistry.

Theoretical studies on binding modes of copper-based nucleases with DNA.

Chunmei Liu, Yanyan Zhu, M. Tang, 2016, Journal of molecular graphics & modelling.

Ligand-Directed Assembly of a Series of Complexes Bearing Thiourea-Based Carboxylates

Xiaofang Guo, Yanyan Zhu, M. Tang, 2011 .

A density functional theory study on mechanisms of [4 + 2] annulation of enal with α‐methylene cycloalkanone catalyzed by N‐heterocyclic carbene

D. Wei, Wenjing Zhang, L. Qu, 2019, International Journal of Quantum Chemistry.

Theoretical understanding mechanisms and stereoselectivities of [2+2] cycloaddition of ketenes with ketimines catalyzed by bifunctional N-heterocyclic carbene

Ling-bo Qu, Yanyan Zhu, Zhenhua Zhu, 2019, Structural Chemistry.

A density functional theory study on mechanism and substituent effects of a base-free and catalyst-free synthesis of functionalized dihydrobenzoxazoles

D. Wei, Wenjing Zhang, Yanyan Zhu, 2018, International Journal of Quantum Chemistry.

Theoretical study on the mechanism and enantioselectivity of NHC-catalyzed intramolecular SN2′ nucleophilic substitution: what are the roles of NHC and DBU?

D. Wei, Wenjing Zhang, Yanyan Zhu, 2018 .

DFT study on reaction mechanisms of cyclic dipeptide generation

Wenjing Zhang, Chunmei Liu, Yanyan Zhu, 2016, Structural Chemistry.

A theoretical study on the mechanisms of the reactions between 1,3-dialkynes and ammonia derivatives for the formation of five-membered N-heterocycles.

D. Wei, Wenjing Zhang, Yang Wang, 2014, Organic & biomolecular chemistry.

DFT study on the reaction mechanisms and stereoselectivities of NHC-catalyzed [2 + 2] cycloaddition between arylalkylketenes and electron-deficient benzaldehydes.

D. Wei, Yang Wang, Yanyan Zhu, 2014, Organic & biomolecular chemistry.

DFT study on the mechanisms and stereoselectivities of the [4 + 2] cycloadditions of enals and chalcones catalyzed by N-heterocyclic carbene.

D. Wei, Yang Wang, Yanyan Zhu, 2014, The Journal of organic chemistry.

A DFT study on the reaction mechanisms of isocyanide-based multicomponent synthesis of polysubstituted cyclopentenes

D. Wei, Yang Wang, Yanyan Zhu, 2013 .

A DFT study on the mechanisms of three-component reaction between imidazoles, isocyanates and cyanophenylacetylene

D. Wei, Shijun Li, Yanyan Zhu, 2013 .

An ESIPT Fluorophore Based on Zinc‐Induced Intramolecular Proton Transfer between Ligands in the Complex

Chunmei Liu, Bin Zhang, Yanyan Zhu, 2017 .

Ferrocene-carboxylate coordination complexes bridged by different N-containing ligands

H. Hou, Shaomin Wang, Yue-Xin Guo, 2013 .

One unprecedented 3-D strontium–organic framework constructed from 2-(3,4-methylenedioxyphenyl)-imidazole dicarboxylate and water ligands

Yanyan Zhu, Gang Li, Li Li, 2013 .

Subtle structure and fluorescence signal changes of four Hg-containing complexes: Influence of the solvents and the halide ions

Jin’an Zhao, H. Hou, Yue-Xin Guo, 2012 .

DFT Study on the Mechanism and Stereoselectivity of NHC-Catalyzed Synthesis of Substituted Trifluoromethyl Dihydropyranones with Contiguous Stereocenters.

Ying Ran, D. Wei, Wenjing Zhang, 2016, The Journal of organic chemistry.

Theoretical simulations on interactions of mono- and dinuclear metallonucleases with DNA.

Chunmei Liu, Yanyan Zhu, M. Tang, 2013, The journal of physical chemistry. B.

Theoretical investigations towards the [4+2] cycloaddition of ketenes with 1-azadienes catalyzed by N-heterocyclic carbenes: mechanism and stereoselectivity

Ying Ran, D. Wei, Wenjing Zhang, 2016 .

Theoretical insights into phosphine‐catalyzed [4 + 2] annulation of allenoates with thiazolone‐derived alkenes

Qiqi Hao, Yi Wang, L. Qu, 2021 .

A DFT study on enantioselective synthesis of aza-β-lactams via NHC-catalyzed [2 + 2] cycloaddition of ketenes with diazenedicarboxylates

Mingsheng Tang, Donghui Wei, Dongzhen Sun, 2011 .

Two zinc(II) complexes based on indole-3-acetic acid: crystal structures, fluorescence sensors, and ion exchange with mercury(II)

Lu Liu, Hong Xu, Bo Xiao, 2011 .

Direct esterification of p-nitrobenzoic acid with n-butanol using diethyl chlorophosphate in pyridine: A DFT study

D. Wei, Wenjing Zhang, Yanyan Zhu, 2011 .

Syntheses, crystal structures and thermal properties of six coordination polymers based on 2-(p-methylphenyl)-imidazole dicarboxylate.

Gang Li, Yu Zhang, Yanyan Zhu, 2013, Dalton transactions.

Assembly of a series of MOFs based on the 2-(m-methoxyphenyl)imidazole dicarboxylate ligand.

Gang Li, Zhengkun Xie, Yanyan Zhu, 2013, Dalton transactions.

Theoretical analysis on alkaline hydrolysis mechanisms of N-(2-methoxyphenyl) benzamide

Yifan Jin, Yanyan Zhu, M. Tang, 2011 .

Molecular dynamics simulations on inclusion complexes for chiral enantiomers with heterocyclic cyclodecapeptide

D. Wei, Chunmei Liu, Yanyan Zhu, 2014 .

Density functional theory studies on the inclusion complexes of cyclic decapeptide with 1-phenyl-1-propanol enantiomers

Chunmei Liu, Yanyan Zhu, M. Tang, 2012, Journal of Molecular Modeling.

DFT studies on inclusion complexes of 1-phenyl-1-propanol enantiomers with modified cyclic decapeptides

D. Wei, Shijun Li, Chunmei Liu, 2014, Structural Chemistry.

Design and synthesis of stable cuprous complexes bearing P∧N-type ligands for vapor-deposited organic light-emitting device

Jinyuan Wang, Chunmei Liu, Bin Zhang, 2019, Organic Electronics.

A theoretical study on synthesis mechanisms of α,β-unsaturated carbon γ-amino ester catalyzed by PPh3

Yanyan Zhu, M. Tang, Zhenhua Zhu, 2017, Structural Chemistry.

Halogen-involving weak interactions manifested in the crystal structures of silver(I) or gold(I) 4-halogenated-3,5-diphenylpyrazolato trimers

S. Ng,, Yanyan Zhu, M. Tang, 2014 .

Computational and experimental assessment on the nonlinear optical properties of platinum(II) arylacetylides with donor-acceptor structures

Xuewei Huang, Yanyan Zhu, Fengqi Guo, 2019, Journal of Organometallic Chemistry.

Quantum chemical study of cyclic dipeptides

Yufen Zhao, Yanyan Zhu, M. Tang, 2007 .

Synthesis, crystal structure and nonlinear optical properties of ferrocene-containing metalloporphyrins

Xuewei Huang, Yanyan Zhu, Fengqi Guo, 2020 .

Investigation of the interaction between isomeric derivatives and human serum albumin by fluorescence spectroscopy and molecular modeling

Junbiao Chang, Chunmei Liu, Yanyan Zhu, 2014 .

Syntheses, structural diversity and properties of three coordination polymers built by chlorophenyl imidazole dicarboxylate

Yanyan Zhu, Gang Li, Zhenna Chen, 2015 .

Insight into the multicomponent reaction mechanisms of prop-2-en-1-amine and ethyl propiolate with alloxan derivative: A density functional theory study

D. Wei, Wenjing Zhang, Yanyan Zhu, 2010 .

Chiral discrimination of cyclodecapeptide to anti-COVID-19 clinical candidates: a theoretical study

Yanyan Zhu, Jian-xin Yang, Shuangshuang Ji, 2023, Structural Chemistry.

Iron and carbon codoped WO3 with hierarchical walnut-like microstructure for highly sensitive and selective acetone sensor

Yanyan Zhu, Yu Xin Zhang, Zhongjun Li, 2018 .

Mechanisms of phosphine‐catalyzed [4 + 3] annulation of allenoates with C, N‐cyclic azomethine imines: A DFT investigation

Chunmei Liu, Yanyan Zhu, M. Tang, 2018 .

Unravelling the Origins of Hydroboration Chemoselectivity Inversion Using an N,O-Chelated Ir(I) Complex: A Computational Study.

D. Wei, Lidong Wang, Shijun Li, 2019, The Journal of organic chemistry.

Binding properties and conformational dynamics of reversible amidines with DNA from a theoretical view

Yanyan Zhu, M. Tang, Juan He, 2011 .

Mechanisms of the cascade synthesis of substituted 4‐amino‐1,2,4‐triazol‐3‐one from huisgen zwitterion and aldehyde hydrazone: A DFT study

Wenjing Zhang, Yanyan Zhu, Mingsheng Tang, 2012, J. Comput. Chem..

Theoretical study on mechanism of cycloaddition reaction between o-alkynylbenzaldoximes and hexynol catalyzed by silver(I)

Shijun Li, Yanyan Zhu, Xiaoyang Yang, 2022, Molecular Catalysis.

Computational and experimental studies on the micellar morphology and emission mechanisms of AIE and H-bonding fluorescent composites

Jian Yang, Hongping Li, Guangying Zhou, 2023, RSC advances.

Theoretical study on binding models of copper nucleases containing pyridyl groups to DNA

D. Wei, Wenjing Zhang, Chunmei Liu, 2015, Theoretical Chemistry Accounts.

Mechanisms and stereoselectivities of the Rh(I)-catalyzed carbenoid carbon insertion reaction of benzocyclobutenol with diazoester.

D. Wei, Wenjing Zhang, Yang Wang, 2015, Organic & biomolecular chemistry.