Novel phytochemical inhibitors targeting monkeypox virus thymidine and serine/threonine kinase: integrating computational modeling and molecular dynamics …

M Patel, AS Bazaid, EI Azhar, HS Gattan… - Journal of …, 2023 - Taylor & Francis
Due to the rapid spread of the monkeypox virus and rise in the number of cases, there is an
urgent need for the development of effective drugs against the infection. Serine/threonine …

A reverse docking approach to explore the anticancer potency of natural compounds by interfering metastasis and angiogenesis

AA Prome, TB Robin, N Ahmed, NA Rani… - Journal of …, 2023 - Taylor & Francis
Angiogenesis, which results in the formation of new blood and lymph vessels, is required to
serve metastatic cancer progression. Cancer medications may target these two …

[HTML][HTML] Molecular docking studies of some benzoxazole and benzothiazole derivatives as VEGFR-2 target inhibitors: in silico design, MD simulation …

SH Abdullahi, AT Moin, A Uzairu, AB Umar… - Intelligent …, 2024 - Elsevier
Breast cancer, a deadly disease among women, demands effective interventions due to its
global impact, with over one million annual cases. Current anti-breast cancer drugs displays …

Designing a polyvalent vaccine targeting multiple strains of varicella zoster virus using integrated bioinformatics approaches

N Amin Rani, AT Moin, R Patil… - Frontiers in …, 2023 - frontiersin.org
The Varicella Zoster Virus (VZV) presents a global health challenge due to its dual
manifestations of chickenpox and shingles. Despite vaccination efforts, incomplete …

Inferring Therapeutic Targets in Candida albicans and Possible Inhibition through Natural Products: A Binding and Physiological Based Pharmacokinetics Snapshot

Z Basharat, K Khan, K Jalal, SM Alnasser, S Majeed… - Life, 2022 - mdpi.com
Despite being responsible for invasive infections, fungal pathogens have been
underrepresented in computer aided therapeutic target mining and drug design. Excess of …