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[HTML][HTML] A guide to in silico drug design
The drug discovery process is a rocky path that is full of challenges, with the result that very
few candidates progress from hit compound to a commercially available product, often due …
few candidates progress from hit compound to a commercially available product, often due …
Carbon nanotubes in biomedical applications: current status, promises, and challenges
BO Murjani, PS Kadu, M Bansod, SS Vaidya… - Carbon Letters, 2022 - Springer
In the past decade, there has been phenomenal progress in the field of nanomaterials,
especially in the area of carbon nanotubes (CNTs). In this review, we have elucidated a …
especially in the area of carbon nanotubes (CNTs). In this review, we have elucidated a …
Nanocarriers based novel and effective drug delivery system
Nanotechnology has ultimately come into the domain of drug delivery. Nanosystems for
delivery of drugs are promptly emerging science utilizing different nanoparticles as carriers …
delivery of drugs are promptly emerging science utilizing different nanoparticles as carriers …
[HTML][HTML] Application of DFT calculations in designing polymer-based drug delivery systems: An overview
Drug delivery systems transfer medications to target locations throughout the body. These
systems are often made up of biodegradable and bioabsorbable polymers acting as delivery …
systems are often made up of biodegradable and bioabsorbable polymers acting as delivery …
Modern carbon–based materials for adsorptive removal of organic and inorganic pollutants from water and wastewater
VI Isaeva, MD Vedenyapina, AY Kurmysheva… - Molecules, 2021 - mdpi.com
Currently, a serious threat for living organisms and human life in particular, is water
contamination with persistent organic and inorganic pollutants. To date, several techniques …
contamination with persistent organic and inorganic pollutants. To date, several techniques …
Carbon nanotubes as an emerging nanocarrier for the delivery of doxorubicin for improved chemotherapy
Carbon nanotubes (CNTs), a versatile nanocarrier for doxorubicin (DOX) delivery had
attracted significant attention in drug delivery of pharmaceuticals. Several properties such as …
attracted significant attention in drug delivery of pharmaceuticals. Several properties such as …
[HTML][HTML] Recent advances in the applications of CNT-based nanomaterials in pharmaceutical nanotechnology and biomedical engineering
Current perspectives on applying functionalized carbon nanotubes (ƒ-CNTs) in
nanomedicine and bioengineering are diversely projected onto designing safe, effective …
nanomedicine and bioengineering are diversely projected onto designing safe, effective …
[HTML][HTML] Advancements in molecular simulation for understanding pharmaceutical pollutant Adsorption: A State-of-the-Art review
I Salahshoori, S Mahdavi, Z Moradi, M Otadi… - Journal of Molecular …, 2024 - Elsevier
The contamination of natural water resources by pharmaceutical pollutants has become a
significant environmental concern. Traditional experimental approaches for understanding …
significant environmental concern. Traditional experimental approaches for understanding …
Enhanced adsorptive removal of indigo carmine dye by bismuth oxide doped MgO based adsorbents from aqueous solution: Equilibrium, kinetic and computational …
Novel doped MgO nanoadsorbents were effectively fabricated at various Bi2O3 do**
concentrations (0, 2.5, 5 and 10%). DFT-D3 study showed that the do** is done by …
concentrations (0, 2.5, 5 and 10%). DFT-D3 study showed that the do** is done by …
[HTML][HTML] A combined DFT, Monte Carlo, and MD simulations of adsorption study of heavy metals on the carbon graphite (111) surface
M Khnifira, W Boumya, J Attarki, A Mahsoune… - Chemical Physics …, 2022 - Elsevier
This work investigated the adsorption mechanism of heavy metals: silver (Ag), mercury (Hg),
cadmium (Cd), palladium (Pd), and zinc (Zn) on the carbon graphite (111) surface based on …
cadmium (Cd), palladium (Pd), and zinc (Zn) on the carbon graphite (111) surface based on …