COVID-19: pathogenesis, advances in treatment and vaccine development and environmental impact—an updated review
Diseases negatively impact the environment, causing many health risks and the spread of
pollution and hazards. A novel coronavirus, severe acute respiratory syndrome coronavirus …
pollution and hazards. A novel coronavirus, severe acute respiratory syndrome coronavirus …
[HTML][HTML] Inhibition of the SARS-CoV-2 3CLpro main protease by plant polyphenols
M Bahun, M Jukić, D Oblak, L Kranjc, G Bajc, M Butala… - Food chemistry, 2022 - Elsevier
The abundance of polyphenols in edible plants makes them an important component of
human nutrition. Considering the ongoing COVID-19 pandemic, a number of studies have …
human nutrition. Considering the ongoing COVID-19 pandemic, a number of studies have …
Structure based virtual screening and molecular simulation study of FDA-approved drugs to inhibit human HDAC6 and VISTA as dual cancer immunotherapy
Cancer immunotherapy has significantly contributed to the treatment of various types of
cancers mainly by targeting immune checkpoint inhibitors (ICI). Among them, V-domain …
cancers mainly by targeting immune checkpoint inhibitors (ICI). Among them, V-domain …
In silico strategies for designing of peptide inhibitors of oncogenic K-ras G12V mutant: inhibiting cancer growth and proliferation
Simple Summary The most well-known oncogene and one with the highest rates of mutation
across all cancers is K-Ras, also known as the Kirsten rat sarcoma viral oncogene …
across all cancers is K-Ras, also known as the Kirsten rat sarcoma viral oncogene …
New drug target identification in Vibrio vulnificus by subtractive genome analysis and their inhibitors through molecular docking and molecular dynamics simulations
Vibrio vulnificus is a rod shape, Gram-negative bacterium that causes sepsis (with a greater
than 50% mortality rate), necrotizing fasciitis, gastroenteritis, skin, and soft tissue infection …
than 50% mortality rate), necrotizing fasciitis, gastroenteritis, skin, and soft tissue infection …
In silico identification of lead compounds for Pseudomonas aeruginosa PqsA enzyme: Computational study to block biofilm formation
Pseudomonas aeruginosa is an opportunistic Gram-negative bacterium implicated in acute
and chronic nosocomial infections and a leading cause of patient mortality. Pseudomonas …
and chronic nosocomial infections and a leading cause of patient mortality. Pseudomonas …
Identification of novel peptide inhibitors for oncogenic KRAS G12D as therapeutic options using mutagenesis-based remodeling and MD simulations
The Kirsten rat sarcoma 2 viral oncogene homolog (KRAS) serves as a molecular switch,
cycling between guanosine triphosphate (GTP)-bound and inactive guanosine diphosphate …
cycling between guanosine triphosphate (GTP)-bound and inactive guanosine diphosphate …
[HTML][HTML] Computational design of medicinal compounds to inhibit RBD-hACE2 interaction in the Omicron variant: Unveiling a vulnerable target site
The COVID-19 pandemic, caused by SARS-CoV-2, has globally affected both human health
and economy. Several variants with a high potential for reinfection and the ability to evade …
and economy. Several variants with a high potential for reinfection and the ability to evade …
In silico design of peptide inhibitors for Dengue virus to treat Dengue virus-associated infections
Dengue virus is a single positive-strand RNA virus that is composed of three structural
proteins including capsid, envelope, and precursor membrane while seven non-structural …
proteins including capsid, envelope, and precursor membrane while seven non-structural …
Cefmetazole sodium as an allosteric effector that regulates the oxygen supply efficiency of adult hemoglobin
P Shu, G You, W Li, Y Chen, Z Chu, D Qin… - Journal of …, 2023 - Taylor & Francis
Allosteric effectors play an important role in regulating the oxygen supply efficiency of
hemoglobin for blood storage and disease treatment. However, allosteric effectors that are …
hemoglobin for blood storage and disease treatment. However, allosteric effectors that are …