Liu XY - Search Results

1

QM/MM nonadiabatic dynamics simulations on photoinduced Wolff rearrangements of 1,2,3-thiadiazole.

Liu XY, Fang YG, Xie BB, Fang WH, Cui G. Liu XY, et al. J Chem Phys. 2017 Jun 14;146(22):224302. doi: 10.1063/1.4984589. J Chem Phys. 2017. PMID: 29166059

2

Excited-state ring-opening mechanism of cyclic ketones: a MS-CASPT2//CASSCF study.

Xia SH, Liu XY, Fang Q, Cui G. Xia SH, et al. Among authors: liu xy. J Phys Chem A. 2015 Apr 16;119(15):3569-76. doi: 10.1021/acs.jpca.5b00302. Epub 2015 Apr 1. J Phys Chem A. 2015. PMID: 25807113

3

Photodissociation dynamics of CH3C(O)SH in argon matrix: A QM/MM nonadiabatic dynamics simulation.

Xia SH, Liu XY, Fang Q, Cui G. Xia SH, et al. Among authors: liu xy. J Chem Phys. 2015 Nov 21;143(19):194303. doi: 10.1063/1.4935598. J Chem Phys. 2015. PMID: 26590533

4

Excited-State Proton-Transfer-Induced Trapping Enhances the Fluorescence Emission of a Locked GFP Chromophore.

Liu XY, Chang XP, Xia SH, Cui G, Thiel W. Liu XY, et al. J Chem Theory Comput. 2016 Feb 9;12(2):753-64. doi: 10.1021/acs.jctc.5b00894. Epub 2016 Jan 15. J Chem Theory Comput. 2016. PMID: 26744782 Free PMC article.

5

Excited-State Intramolecular Proton Transfer in a Blue Fluorescence Chromophore Induces Dual Emission.

Wu D, Guo WW, Liu XY, Cui G. Wu D, et al. Among authors: liu xy. Chemphyschem. 2016 Aug 4;17(15):2340-7. doi: 10.1002/cphc.201600386. Epub 2016 May 11. Chemphyschem. 2016. PMID: 27128380

6

Photoisomerization of Arylazopyrazole Photoswitches: Stereospecific Excited-State Relaxation.

Wang YT, Liu XY, Cui G, Fang WH, Thiel W. Wang YT, et al. Among authors: liu xy. Angew Chem Int Ed Engl. 2016 Nov 2;55(45):14009-14013. doi: 10.1002/anie.201607373. Epub 2016 Oct 6. Angew Chem Int Ed Engl. 2016. PMID: 27709760 Free PMC article.

7

The Position of the N Atom Plays a Significant Role for Excited-State Decay of Heterocycles.

Xie BB, Liu XY, Fang Q, Fang WH, Cui G. Xie BB, et al. Among authors: liu xy. J Phys Chem Lett. 2017 Mar 2;8(5):1019-1024. doi: 10.1021/acs.jpclett.6b02897. Epub 2017 Feb 16. J Phys Chem Lett. 2017. PMID: 28196326

8

Excited-State Decay Paths in Tetraphenylethene Derivatives.

Gao YJ, Chang XP, Liu XY, Li QS, Cui G, Thiel W. Gao YJ, et al. Among authors: liu xy. J Phys Chem A. 2017 Apr 6;121(13):2572-2579. doi: 10.1021/acs.jpca.7b00197. Epub 2017 Mar 28. J Phys Chem A. 2017. PMID: 28318255 Free PMC article.

9

Covalent-reaction-induced interfacial assembly to transform doxorubicin into nanophotomedicine with highly enhanced anticancer efficiency.

Qin C, Fei J, Cui G, Liu X, Fang W, Yang X, Liu X, Li J. Qin C, et al. Phys Chem Chem Phys. 2017 Sep 13;19(35):23733-23739. doi: 10.1039/c7cp02543b. Phys Chem Chem Phys. 2017. PMID: 28585943

10

Theoretical studies of spin state-specific [2 + 2] and [5 + 2] photocycloaddition reactions of n-(1-penten-5-yl)maleimide.

Liu XY, Xiao P, Fang WH, Cui G. Liu XY, et al. J Comput Chem. 2017 Oct 30;38(28):2388-2395. doi: 10.1002/jcc.24897. Epub 2017 Jul 31. J Comput Chem. 2017. PMID: 28762255

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