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1.
Ag-Doped WO3 Nanoplates as Heterogenous Multifunctional Catalyst for Glycerol Acetylation, Electrocatalytic and Enhanced Photocatalytic Hydrogen Production.
Langmuir
; 39(27): 9300-9314, 2023 Jul 11.
Artículo
en Inglés
| MEDLINE | ID: mdl-37382455
2.
Organochalcogen substituted dimesityl borane-imidazoles as fluorogenic fluoride and cyanide sensors in aqueous media.
Analyst
; 148(10): 2362-2374, 2023 May 16.
Artículo
en Inglés
| MEDLINE | ID: mdl-37128863
3.
Molecular modeling, synthesis, antibacterial and cytotoxicity evaluation of sulfonamide derivatives of benzimidazole, indazole, benzothiazole and thiazole.
Bioorg Med Chem
; 26(12): 3414-3428, 2018 07 23.
Artículo
en Inglés
| MEDLINE | ID: mdl-29778528
4.
Deep Learning in Drug Discovery and Medicine; Scratching the Surface.
Molecules
; 23(9)2018 Sep 18.
Artículo
en Inglés
| MEDLINE | ID: mdl-30231499
5.
Escherichia coli modulates its motor speed on sensing an attractant.
Arch Microbiol
; 198(8): 827-33, 2016 Oct.
Artículo
en Inglés
| MEDLINE | ID: mdl-27318664
6.
Hydroxyalkynyl uracil derivatives as NNRTIs against HIV-1: in silico predictions, synthesis, docking and molecular dynamics simulation studies.
J Biomol Struct Dyn
; 41(16): 8068-8080, 2023.
Artículo
en Inglés
| MEDLINE | ID: mdl-36229234
7.
Exploring antiviral potency of N-1 substituted pyrimidines against HIV-1 and other DNA/RNA viruses: Design, synthesis, characterization, ADMET analysis, docking, molecular dynamics and biological activity.
Comput Biol Chem
; 106: 107910, 2023 Oct.
Artículo
en Inglés
| MEDLINE | ID: mdl-37422940
8.
In silico evaluation of S-adenosyl-L-homocysteine analogs as inhibitors of nsp14-viral cap N7 methyltranferase and PLpro of SARS-CoV-2: synthesis, molecular docking, physicochemical data, ADMET and molecular dynamics simulations studies.
J Biomol Struct Dyn
; : 1-18, 2023 Dec 26.
Artículo
en Inglés
| MEDLINE | ID: mdl-38147408
9.
A Significant Role of Chemistry in Drug Development: A Systematic Journey from Traditional to Modern Approaches with Anti-HIV/AIDS Drugs as Examples.
Curr Pharm Des
; 28(3): 232-247, 2022.
Artículo
en Inglés
| MEDLINE | ID: mdl-34727852
10.
Modified, Solvothermally Derived Cr-doped SnO2 Nanostructures for Enhanced Photocatalytic and Electrochemical Water-Splitting Applications.
ACS Omega
; 7(16): 14138-14147, 2022 Apr 26.
Artículo
en Inglés
| MEDLINE | ID: mdl-35559165
11.
Design, synthesis, and molecular dynamics simulation studies of quinoline derivatives as protease inhibitors against SARS-CoV-2.
J Biomol Struct Dyn
; 40(21): 10519-10542, 2022.
Artículo
en Inglés
| MEDLINE | ID: mdl-34253149
12.
Microfluidics-based generation of cell encapsulated microbeads in the presence of electric fields and spatio-temporal viability studies.
Colloids Surf B Biointerfaces
; 208: 112065, 2021 Dec.
Artículo
en Inglés
| MEDLINE | ID: mdl-34478958
13.
Ligand sensing enhances bacterial flagellar motor output via stator recruitment.
Elife
; 102021 04 06.
Artículo
en Inglés
| MEDLINE | ID: mdl-33821791
14.
Anti-HIV potential of diarylpyrimidine derivatives as non-nucleoside reverse transcriptase inhibitors: design, synthesis, docking, TOPKAT analysis and molecular dynamics simulations.
J Biomol Struct Dyn
; 39(7): 2430-2446, 2021 Apr.
Artículo
en Inglés
| MEDLINE | ID: mdl-32216610
15.
Multifunctional Efficacy of Environmentally Benign Silver Nanospheres for Organic Transformation, Photocatalysis, and Water Remediation.
ACS Omega
; 5(40): 26063-26076, 2020 Oct 13.
Artículo
en Inglés
| MEDLINE | ID: mdl-33073133
16.
Alkylated benzimidazoles: Design, synthesis, docking, DFT analysis, ADMET property, molecular dynamics and activity against HIV and YFV.
Comput Biol Chem
; 89: 107400, 2020 Dec.
Artículo
en Inglés
| MEDLINE | ID: mdl-33068917
17.
Synthesis, docking, ADMET prediction, cytotoxicity and antimicrobial activity of oxathiadiazole derivatives.
Comput Biol Chem
; 77: 226-239, 2018 Dec.
Artículo
en Inglés
| MEDLINE | ID: mdl-30366286
18.
Synthesis, antibacterial activity, synergistic effect, cytotoxicity, docking and molecular dynamics of benzimidazole analogues.
Comput Biol Chem
; 76: 1-16, 2018 Oct.
Artículo
en Inglés
| MEDLINE | ID: mdl-29857255
19.
Supervised learning reveals circulating biomarker levels diagnostic of hepatocellular carcinoma in a clinically relevant model of non-alcoholic steatohepatitis; An OAD to NASH.
PLoS One
; 13(6): e0198937, 2018.
Artículo
en Inglés
| MEDLINE | ID: mdl-29944670
20.
Kidney Appreciates Stable Blood Pressure.
Am J Hypertens
; 31(5): 532-533, 2018 04 13.
Artículo
en Inglés
| MEDLINE | ID: mdl-29272328
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