Detalhe da pesquisa
1.
Mechanical Activation of Forbidden Photoreactivity in Oxa-di-π-methane Rearrangement.
J Org Chem
; 87(19): 12586-12595, 2022 10 07.
Artigo
em Inglês
| MEDLINE | ID: mdl-36166757
2.
The concept of substituent-induced force in the rationale of substituent effect.
J Chem Phys
; 154(22): 224106, 2021 Jun 14.
Artigo
em Inglês
| MEDLINE | ID: mdl-34241192
3.
Optomechanical Control of Quantum Yield in Trans-Cis Ultrafast Photoisomerization of a Retinal Chromophore Model.
Angew Chem Int Ed Engl
; 56(14): 3842-3846, 2017 03 27.
Artigo
em Inglês
| MEDLINE | ID: mdl-28251753
4.
Molcas 8: New capabilities for multiconfigurational quantum chemical calculations across the periodic table.
J Comput Chem
; 37(5): 506-41, 2016 Feb 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-26561362
5.
Study of Model Systems for Bilirubin and Bilin Chromophores: Determination and Modification of Thermal and Photochemical Properties.
J Org Chem
; 81(15): 6292-302, 2016 08 05.
Artigo
em Inglês
| MEDLINE | ID: mdl-27391671
6.
A biomimetic molecular switch at work: coupling photoisomerization dynamics to peptide structural rearrangement.
Phys Chem Chem Phys
; 18(9): 6742-53, 2016 Mar 07.
Artigo
em Inglês
| MEDLINE | ID: mdl-26876376
7.
Hydantoin-based molecular photoswitches.
J Org Chem
; 80(8): 3929-39, 2015 Apr 17.
Artigo
em Inglês
| MEDLINE | ID: mdl-25806596
8.
Definition and determination of the triplet-triplet energy transfer reaction coordinate.
J Chem Phys
; 140(3): 034102, 2014 Jan 21.
Artigo
em Inglês
| MEDLINE | ID: mdl-25669358
9.
Modulating Efficiency and Color of Thermally Activated Delayed Fluorescence by Rationalizing the Substitution Effect.
J Chem Theory Comput
; 20(10): 4239-4253, 2024 May 28.
Artigo
em Inglês
| MEDLINE | ID: mdl-38738688
10.
An Algorithm Predicting the Optimal Mechanical Response of Electronic Energy Difference.
J Chem Theory Comput
; 19(18): 6392-6401, 2023 Sep 26.
Artigo
em Inglês
| MEDLINE | ID: mdl-37669417
11.
Modulating nitric oxide release by S-nitrosothiol photocleavage: mechanism and substituent effects.
J Phys Chem A
; 116(26): 7039-49, 2012 Jul 05.
Artigo
em Inglês
| MEDLINE | ID: mdl-22667985
12.
The ultrafast photoisomerizations of rhodopsin and bathorhodopsin are modulated by bond length alternation and HOOP driven electronic effects.
J Am Chem Soc
; 133(10): 3354-64, 2011 Mar 16.
Artigo
em Inglês
| MEDLINE | ID: mdl-21341699
13.
Thermodynamic, kinetic, and mechanistic study of oxygen atom transfer from mesityl nitrile oxide to phosphines and to a terminal metal phosphido complex.
Inorg Chem
; 50(19): 9620-30, 2011 Oct 03.
Artigo
em Inglês
| MEDLINE | ID: mdl-21875050
14.
First principles study of photostability within hydrogen-bonded amino acids.
Phys Chem Chem Phys
; 13(17): 7805-11, 2011 May 07.
Artigo
em Inglês
| MEDLINE | ID: mdl-21403960
15.
Photochemistry of hydrogen-bonded aromatic pairs: Quantum dynamical calculations for the pyrrole-pyridine complex.
Proc Natl Acad Sci U S A
; 105(35): 12707-12, 2008 Sep 02.
Artigo
em Inglês
| MEDLINE | ID: mdl-18663223
16.
Thermal and Mechanochemical Tuning of the Porphyrin Singlet-Triplet Gap for Selective Energy Transfer Processes: A Molecular Dynamics Approach.
J Chem Theory Comput
; 17(9): 5429-5439, 2021 Sep 14.
Artigo
em Inglês
| MEDLINE | ID: mdl-34351751
17.
Real-world effectiveness and tolerability of Zelesse cream® for treating vulvovaginitis in adult women: an observational, prospective study.
J Int Med Res
; 49(5): 3000605211013226, 2021 May.
Artigo
em Inglês
| MEDLINE | ID: mdl-33983051
18.
Modeling, preparation, and characterization of a dipole moment switch driven by Z/E photoisomerization.
J Am Chem Soc
; 132(27): 9310-9, 2010 Jul 14.
Artigo
em Inglês
| MEDLINE | ID: mdl-20568762
19.
How mechanical forces can modulate the metal affinity and selectivity of metal binding sites in proteins.
Metallomics
; 12(3): 363-370, 2020 03 01.
Artigo
em Inglês
| MEDLINE | ID: mdl-31909407
20.
Photoreactivity Control Mediated by Molecular Force Probes in Stilbene.
J Phys Chem Lett
; 10(5): 1063-1067, 2019 Mar 07.
Artigo
em Inglês
| MEDLINE | ID: mdl-30707586