Xingzhu Tang

Mechanistic insights into charge-transfer quenching and low-barrier ESIPT in an H2S-responsive fluorescent probe: a DFT/TD-DFT study

Xin Tian, Xingzhu Tang, Chaofan Sun

cn (code pays fourni par la source)

Regulation of photophysical properties of ESIPT-type benzothiazole derivatives via atomic electronegativity modulation: A DFT/TD-DFT study

Zhihui Duan, Xingzhu Tang, Chaofan Sun

cn (code pays fourni par la source)

Substituent-dependent ESIPT mechanisms and photophysical properties of ethyl-(Z)-4-(2-(3-(benzo[d]thiazol-2-yl)-2-hydroxy-5-methylphenyl)-1-cyanovinyl) benzoate

Xiaolin Zhu (212643), Yankun Liu, Xingzhu Tang, Chaofan Sun et autres

cn (code pays fourni par la source)

Synergistic effect of ESIPT and hRISC properties for 2-(benzo[d]thiazol-2-yl)-4-(pyren-1-yl)phenol: A theoretical study on solvent-dependent excited-state dynamics

Xin Tian, Xingzhu Tang, Lei Wang, Chaofan Sun

cn (code pays fourni par la source)

Enhancing Antioxidant and Anti-Inflammatory Activities of ESIntraPT/ESInterPT-Type 6-Methoxyflavone: Insights from DFT/TD-DFT, Molecular Docking, and Molecular Dynamics Simulations

Xingzhu Tang, Y. Wang, Lingling Wang, Xin Tian et autres

Development of antioxidant-type anti-inflammatory inhibitors is essential to mitigate free radical-mediated inflammatory damage, where natural flavonoids with multiple bioactivities are promising candidate compounds. By employing density functional theory/time-dependent density functional theory, molecular docking, and molecular dynamics simulations, the association between excited-state intramolecular/intermolecular …

cn, Égypte (code pays fourni par la source)

Effect of external electric fields on the ESIPT process and photophysical properties of benzothiadiazole derivative

Yulei Zhang, Xingzhu Tang, Lei Wang, Ye Wang et autres

cn (code pays fourni par la source)

Theoretical Investigation on the Excited-State Proton Transfer Mechanism of 2-(1 H-benzo[d]imidazol-2-yl)-6-(benzo[d]thiazol-2-yl)-4-bromophenol

Xin Tian, Xingzhu Tang, Ye Wang, Chaofan Sun

cn (code pays fourni par la source)

A fluorescent probe 2-(5-bromo-2-((tert-butyldiphenylsilyl)oxy)phenyl)imidazo[1,2-a]pyridine for the detection of F−: Theoretical investigation on the ESIPT mechanism

Xiaolin Zhu, Xingzhu Tang, Ye Wang, Chaofan Sun

cn (code pays fourni par la source)

Excited-state genistein and its methoxy derivatives with improved antioxidant activity: DFT/TD-DFT calculations, molecular docking, and molecular dynamic simulation

Xingzhu Tang, Chaofan Sun, Lingling Wang

cn (code pays fourni par la source)

Photophysical properties of the fluorescent probe NHI for the detection of phosgene based on ESIPT process: A DFT/TD-DFT study

Yuqi Wang, Ziqi Zhao, Xingzhu Tang, Dapeng Yang et autres

cn (code pays fourni par la source)

Photoluminescence property of ESIPT-based HBIA-2OH combined with solvent effect: A theoretical study

Xingzhu Tang, Xin Tian, Yulei Zhang, Ye Wang et autres

cn (code pays fourni par la source)

Unveiling antioxidant and tyrosinase inhibitory activities of ESIPT-based flavonoids: DFT/TD-DFT calculations and molecular docking

Xingzhu Tang, Chaofan Sun, Xin Tian, Yulei Zhang et autres

cn (code pays fourni par la source)