Jianping Wang

发表

Molecular simulation study of the binding mechanism of [α-PTi2W10O40]7− for its promising broad-spectrum inhibitory activity to FluV-A neuraminidase

Zhongmin Su, Jianping Wang, Donghua Hu, 2010, Chinese science bulletin = Kexue tongbao.

TDDFT studies on the determination of the absolute configurations and chiroptical properties of Strandberg-type polyoxometalates.

Z. Su, Likai Yan, Nana Ma, 2013, The journal of physical chemistry. A.

TDDFT studies on electronic structures, chiroptical properties and solvent effect on the CD spectra of diphosphonate-functionalized polyoxomolybdates.

Z. Su, Likai Yan, Nana Ma, 2013, Journal of molecular graphics & modelling.

A DFT study on the second-order nonlinear optical properties of the plenary mixed-metal polyoxometalate

Z. Su, Shan Cong, Likai Yan, 2012 .

Theoretical discussions on electron transport properties of perylene bisimide derivatives with different molecular packings and intermolecular interactions

Z. Su, Guochun Yang, Y. Geng, 2011 .

DFT studies on the electronic properties of organometallic-polyoxomolybdate anions [Cpn∗Mo6O19−n](2−n)− (n = 1 or 2): Revealing bonding features of Cp∗–Mo

Z. Su, Likai Yan, Jianping Wang, 2011 .

TDDFT studies on chiral organophosphonate substituted divacant Keggin-type polyoxotungstate: diplex multistep-redox-triggered chiroptical and NLO switch.

Z. Su, Likai Yan, Shi-Zheng Wen, 2012, Dalton transactions.

TDDFT studies on the structures and ECD spectra of chiral bisarylimidos bearing different lengths of o-alkoxy chain-substituted polyoxomolybdates.

Z. Su, Likai Yan, Guo Yang, 2012, Journal of molecular graphics & modelling.

The structure-property relationship of chiral 1,1'-binaphthyl-based polyoxometalates: TDDFT studies on the static first hyperpolarizabilities and the ECD spectra.

Z. Su, Likai Yan, Shi-Zheng Wen, 2012, Journal of molecular graphics & modelling.

Molecular dynamic and quantum mechanics study of drug recognition for the extremity of DNA G-quadruplex groove

Zhongmin Su, Jianping Wang, Donghua Hu, 2012, Medicinal Chemistry Research.

Identification of nonplanar small molecule for G-quadruplex grooves: molecular docking and molecular dynamic study.

Lihong Hu, Zhongmin Su, Jianping Wang, 2011, Bioorganic & medicinal chemistry letters.

Influence of the central atom on the electronic properties of Lindqvist polyoxometalates

Z. Su, Likai Yan, Shi-Zheng Wen, 2012 .

TDDFT studies on the electronic structures and chiroptical properties of mono-tin-substituted Wells-Dawson polyoxotungstates.

Z. Su, Likai Yan, Jianping Wang, 2012, The journal of physical chemistry. A.

Theoretical investigation of structural and electronic propertyies of [PW12O40]3- on graphene layer.

Zhongling Lang, Zhongmin Su, Likai Yan, 2012, Dalton transactions.

Theoretical investigation of structural and electronic propertyies of [PW12O40]3- on graphene layer.

Zhongling Lang, Zhongmin Su, Likai Yan, 2012, Dalton transactions.