[HTML][HTML] On the application of 3d metals for C–H activation toward bioactive compounds: The key step for the synthesis of silver bullets

RL Carvalho, AS de Miranda… - Beilstein Journal of …, 2021‏ - beilstein-journals.org
Several valuable biologically active molecules can be obtained through C–H activation
processes. However, the use of expensive and not readily accessible catalysts complicates …

Asymmetric Disulfanylbenzamides as Irreversible and Selective Inhibitors of Staphylococcus aureus Sortase A

F Barthels, G Marincola, T Marciniak… - …, 2020‏ - Wiley Online Library
Staphylococcus aureus is one of the most frequent causes of nosocomial and community‐
acquired infections, with drug‐resistant strains being responsible for tens of thousands of …

Synthesis, Antimicrobial Activity, Molecular Docking and DFT Study: Aryl‐Carbamic Acid 1‐Benzyl‐1H‐[1,2,3]Triazol‐4‐ylmethyl Esters

Naveen, R Kumar Tittal, GD Vikas, P Rani… - …, 2020‏ - Wiley Online Library
Abstract Bioactive carbamate‐1, 4‐disubstituted 1, 2, 3‐triazole hybrid molecules were
synthesized and characterized in high yield from carbamate‐linked terminal alkynes and in …

[PDF][PDF] A brief overview on HIV infection, diagnosis and treatment

M Saha, S Bhattacharya - Current Topics in Medicinal Chemistry, 2019‏ - researchgate.net
AIDS (Acquired Immune Deficiency Syndrome), the disease caused through HIV (Human
Immunodeficiency Virus) infection, continues as a major public health issue globally. In …

Molecular dynamics applied to discover antiviral agents

IJ dos Santos Nascimento, TM de Aquino… - … Chemistry: Volume 6, 2022‏ - benthamdirect.com
In recent years, the world has faced several outbreaks caused by viral diseases, resulting in
deaths and comorbidities, harming the health of the population. Due to the" constant" …

Prodrug Strategy Extends the Use of Anti-HIV Sulfanylbenzamides for Application In Vivo

M Robello, H Nikolayevskiy, MT Scerba… - ACS Pharmacology & …, 2023‏ - ACS Publications
Sulfanylbenzamide thioesters are molecules with anti-HIV activity that disrupt zinc
coordination in the viral protein NCp7. These molecules are useful as topical microbicides; …

A combined molecular dynamics simulation and DFT study on mercapto-benzamide inhibitors for the HIV NCp7 protein

R Cardia, G Cappellini, M Valentini… - Physical Chemistry …, 2022‏ - pubs.rsc.org
Molecular dynamics and quantum simulations are performed to elucidate some aspects of
the action mechanism of mercapto-benzamides, a proposed class of antivirals against HIV …