Detalles de la búsqueda
1.
In Vivo and in Silico Based Evaluation of Antidiabetic Potential of an Isolated Flavonoid from Allium hookeri in Type 2 Diabetic Rat Model.
Chem Biodivers;
21(1): e202301299, 2024 Jan.
Artículo
en Inglés
| MEDLINE | ID: mdl-38047518
2.
Computational guided identification of a citrus flavonoid as potential inhibitor of SARS-CoV-2 main protease.
Mol Divers;
25(3): 1745-1759, 2021 Aug.
Artículo
en Inglés
| MEDLINE | ID: mdl-33236176
3.
Identification of potential plant-based inhibitor against viral proteases of SARS-CoV-2 through molecular docking, MM-PBSA binding energy calculations and molecular dynamics simulation.
Mol Divers;
25(3): 1963-1977, 2021 Aug.
Artículo
en Inglés
| MEDLINE | ID: mdl-33856591
4.
In Vivo Validation of Folkloric Use of Costus pictus D. Don as Antidiabetic Plant in Assam, Using Streptozotocin Induced Wister Rat Model.
Indian J Clin Biochem;
35(2): 225-231, 2020 Apr.
Artículo
en Inglés
| MEDLINE | ID: mdl-32226255
5.
Ruthenium(II)-Catalyzed Synthesis of Spirobenzofuranones by a Decarbonylative Annulation Reaction.
Angew Chem Int Ed Engl;
57(2): 456-460, 2018 01 08.
Artículo
en Inglés
| MEDLINE | ID: mdl-29154498
6.
Design, in silico and in vitro evaluation of curcumin analogues against Plasmodium falciparum.
Exp Parasitol;
175: 51-58, 2017 Apr.
Artículo
en Inglés
| MEDLINE | ID: mdl-28188731
7.
Novel series of 1,2,4-trioxane derivatives as antimalarial agents.
J Enzyme Inhib Med Chem;
32(1): 1159-1173, 2017 Dec.
Artículo
en Inglés
| MEDLINE | ID: mdl-28870093
8.
In vitro and in silico guided identification of antimalarial phytoconstituent(s) in the root of Citrus maxima (Burm.) Merr.
J Biomol Struct Dyn;
: 1-12, 2023 Nov 17.
Artículo
en Inglés
| MEDLINE | ID: mdl-37975318
9.
Revelation of potential drug targets of luteolin in Plasmodium falciparum through multi-target molecular dynamics simulation studies.
J Biomol Struct Dyn;
: 1-17, 2023 Sep 29.
Artículo
en Inglés
| MEDLINE | ID: mdl-37776013
10.
Multi-target molecular dynamic simulations reveal glutathione-S-transferase as the most favorable drug target of knipholone in Plasmodium falciparum.
J Biomol Struct Dyn;
41(22): 12808-12824, 2023.
Artículo
en Inglés
| MEDLINE | ID: mdl-36752355
11.
Integrated computational approach towards repurposing of antimalarial drug against SARS-CoV-2 main protease.
Struct Chem;
33(5): 1409-1422, 2022.
Artículo
en Inglés
| MEDLINE | ID: mdl-35669793
12.
Antiviral phytocompounds "ellagic acid" and "(+)-sesamin" of Bridelia retusa identified as potential inhibitors of SARS-CoV-2 3CL pro using extensive molecular docking, molecular dynamics simulation studies, binding free energy calculations, and bioactivity prediction.
Struct Chem;
33(5): 1445-1465, 2022.
Artículo
en Inglés
| MEDLINE | ID: mdl-35571865
13.
Repurposing of phytomedicine-derived bioactive compounds with promising anti-SARS-CoV-2 potential: Molecular docking, MD simulation and drug-likeness/ADMET studies.
Saudi J Biol Sci;
29(4): 2432-2446, 2022 Apr.
Artículo
en Inglés
| MEDLINE | ID: mdl-34924801
14.
Identification of bioactive molecules from Triphala (Ayurvedic herbal formulation) as potential inhibitors of SARS-CoV-2 main protease (Mpro) through computational investigations.
J King Saud Univ Sci;
34(3): 101826, 2022 Apr.
Artículo
en Inglés
| MEDLINE | ID: mdl-35035181
15.
Multiple-targets Directed Screening of Flavonoid Compounds from Citrus Species to find out Antimalarial Lead with Predicted Mode of Action: An In Silico and Whole Cell-based In vitro Approach.
Curr Comput Aided Drug Des;
17(1): 69-82, 2021.
Artículo
en Inglés
| MEDLINE | ID: mdl-31878860
16.
Design, molecular docking, drug-likeness, and molecular dynamics studies of 1,2,4-trioxane derivatives as novel Plasmodium falciparum falcipain-2 (FP-2) inhibitors.
BioTechnologia (Pozn);
102(3): 257-275, 2021.
Artículo
en Inglés
| MEDLINE | ID: mdl-36606151
17.
Computational guided identification of potential leads from Acacia pennata (L.) Willd. as inhibitors for cellular entry and viral replication of SARS-CoV-2.
Futur J Pharm Sci;
7(1): 201, 2021.
Artículo
en Inglés
| MEDLINE | ID: mdl-34660817
18.
Potential anti-viral activity of approved repurposed drug against main protease of SARS-CoV-2: an in silico based approach.
J Biomol Struct Dyn;
39(10): 3802-3811, 2021 07.
Artículo
en Inglés
| MEDLINE | ID: mdl-32406317
19.
Design, Synthesis, Antimalarial Activity and Docking Study of 7-Chloro-4- (2-(substituted benzylidene)hydrazineyl)quinolines.
Med Chem;
16(7): 928-937, 2020.
Artículo
en Inglés
| MEDLINE | ID: mdl-31385774
20.
A Simple Work-Up-free, Solvent-free Approach to Novel Amino Acid Linked 1,4-Disubstituted 1,2,3-Triazoles as Potent Antituberculosis Agents.
ACS Omega;
5(46): 29830-29837, 2020 Nov 24.
Artículo
en Inglés
| MEDLINE | ID: mdl-33251417