Detalhe da pesquisa
1.
Chiral Recognition of Amino Acids Using CC2 Porous Organic Cages.
J Phys Chem A
; 127(19): 4245-4258, 2023 May 18.
Artigo
em Inglês
| MEDLINE | ID: mdl-37155274
2.
Synthesis of Functionalized Thiophene Based Pyrazole Amides via Various Catalytic Approaches: Structural Features through Computational Applications and Nonlinear Optical Properties.
Molecules
; 27(2)2022 Jan 07.
Artigo
em Inglês
| MEDLINE | ID: mdl-35056676
3.
Electronic structure of polypyrrole composited with a low percentage of graphene nanofiller.
Phys Chem Chem Phys
; 23(14): 8557-8570, 2021 Apr 14.
Artigo
em Inglês
| MEDLINE | ID: mdl-33876018
4.
Palladium(0) Catalyzed Synthesis of (E)-4-Bromo-N-((3-bromothiophen-2-yl)methylene)-2-methylaniline Derivatives via Suzuki Cross-Coupling Reaction: An Exploration of Their Non-Linear Optical Properties, Reactivity and Structural Features.
Molecules
; 26(18)2021 Sep 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-34577076
5.
Facile Synthesis of 5-Aryl-N-(pyrazin-2-yl)thiophene-2-carboxamides via Suzuki Cross-Coupling Reactions, Their Electronic and Nonlinear Optical Properties through DFT Calculations.
Molecules
; 26(23)2021 Dec 02.
Artigo
em Inglês
| MEDLINE | ID: mdl-34885891
6.
Accurate prediction of the optical rotation and NMR properties for highly flexible chiral natural products.
Phys Chem Chem Phys
; 18(35): 24506-10, 2016 Sep 21.
Artigo
em Inglês
| MEDLINE | ID: mdl-27539138
7.
Determination of the Absolute Configuration of Ballonigrin Lactone A Using Density Functional Theory Calculations.
ACS Omega
; 8(2): 1923-1928, 2023 Jan 17.
Artigo
em Inglês
| MEDLINE | ID: mdl-36687041
8.
Investigation of Novel Benzoxazole-Oxadiazole Derivatives as Effective Anti-Alzheimer's Agents: In Vitro and In Silico Approaches.
Pharmaceuticals (Basel)
; 16(7)2023 Jun 21.
Artigo
em Inglês
| MEDLINE | ID: mdl-37513821
9.
Anticancer Properties of Ru and Os Half-Sandwich Complexes of N,S Bidentate Schiff Base Ligands Derived from Phenylthiocarbamide.
Chem Asian J
; 18(23): e202300804, 2023 Dec 01.
Artigo
em Inglês
| MEDLINE | ID: mdl-37737043
10.
Permeability of boron- and nitrogen-doped graphene nanoflakes for protium/deuterium ions.
RSC Adv
; 12(7): 3883-3891, 2022 Jan 28.
Artigo
em Inglês
| MEDLINE | ID: mdl-35425466
11.
In Vitro Screening and MD Simulations of Thiourea Derivatives against SARS-CoV-2 in Association with Multidrug Resistance ABCB1 Transporter.
ACS Omega
; 7(51): 47671-47679, 2022 Dec 27.
Artigo
em Inglês
| MEDLINE | ID: mdl-36569212
12.
Computational investigation of a covalent triazine framework (CTF-0) as an efficient electrochemical sensor.
RSC Adv
; 12(7): 3909-3923, 2022 Jan 28.
Artigo
em Inglês
| MEDLINE | ID: mdl-35425404
13.
Synthesis, Carbonic Anhydrase II/IX/XII Inhibition, DFT, and Molecular Docking Studies of Hydrazide-Sulfonamide Hybrids of 4-Methylsalicyl- and Acyl-Substituted Hydrazide.
Biomed Res Int
; 2022: 5293349, 2022.
Artigo
em Inglês
| MEDLINE | ID: mdl-35252449
14.
Finding New Precursors for Light Harvesting Materials: A Computational Study of the Fluorescence Potential of Benzanthrone Dyes.
ACS Omega
; 6(47): 32334-32341, 2021 Nov 30.
Artigo
em Inglês
| MEDLINE | ID: mdl-34870053
15.
A Novel Technique for Thyroplasty Type 1, With Prolene Mesh Implant.
J Voice
; 2021 Oct 24.
Artigo
em Inglês
| MEDLINE | ID: mdl-34706848
16.
A new secoiridoid glycosidic lignan ester from the leaves of Olea ferruginea.
Magn Reson Chem
; 53(2): 163-6, 2015 Feb.
Artigo
em Inglês
| MEDLINE | ID: mdl-25169706
17.
Main-group metal cyclophane complexes with high coordination numbers.
RSC Adv
; 10(51): 30796-30805, 2020 Aug 17.
Artigo
em Inglês
| MEDLINE | ID: mdl-35516020
18.
The C2N surface as a highly selective sensor for the detection of nitrogen iodide from a mixture of NX3 (X = Cl, Br, I) explosives.
RSC Adv
; 10(53): 31997-32010, 2020 Aug 26.
Artigo
em Inglês
| MEDLINE | ID: mdl-35518175
19.
Permeation of second row neutral elements through Al12P12 and B12P12 nanocages; a first-principles study.
J Mol Graph Model
; 101: 107748, 2020 12.
Artigo
em Inglês
| MEDLINE | ID: mdl-32971489
20.
Design, synthesis, and spasmolytic activity of thiophene-based derivatives via Suzuki cross-coupling reaction of 5-bromothiophene-2-carboxylic acid: their structural and computational studies.
Turk J Chem
; 44(5): 1410-1422, 2020.
Artigo
em Inglês
| MEDLINE | ID: mdl-33488240