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In Silico Pharmacology|March 17, 2025
In silico docking and ADMET studies on clinical targets for type 2 diabetes correlated to in vitro inhibition of pancreatic alpha-amylase and alpha-glucosidase by rutin, caffeic acid, p-coumaric acid, and vanillinJamie McMillan, Megan Jean Bester, Zeno Apostolides
In Silico Pharmacology|February 28, 2025
In-silico structural and functional analysis of nonsynonymous single nucleotide polymorphisms in human FOLH1 geneAbtin Tondar, Muhammad Irfan, Sergio Sánchez-Herrero, et al.
In Silico Pharmacology|February 24, 2025
Molecular modeling of the interactions of compounds of Irvinga wombulu against dihydrofolate reductase-thymidylate synthase in Plasmodium falciparum towards development of anti-malarial drugAmarachi Chike-Ekwughe, Hassan Taiye Abdulameed, Grace I Adebayo-Gege, et al.
In Silico Pharmacology|February 17, 2025
Tinospora cordifolia bioactive compounds as a novel sterol 14a-demethylase (CYP51) inhibitor: an in silico studyKolawole T Mesileya, Precious C Onyeka, Iyidola M Adaramola, et al.
In Silico Pharmacology|February 20, 2025
Afobazole: a potential drug candidate which can inhibit SARS CoV-2 and mimicry of the human respiratory pacemaker proteinGovinda Rao Dabburu, Anjali Garg, Neelja Singhal, et al.
In Silico Pharmacology|November 11, 2024
Development of a Multiple-Epitope-Based Vaccine for Hepatitis C Virus Genotypes 1a and 1b: an in-silico reverse vaccinology approachEnakshi Das, Mahesh Samantaray, Kajal Abrol, et al.
In Silico Pharmacology|October 28, 2024
A pan-genomic analysis based multi-epitope vaccine development by targeting Stenotrophomonas maltophilia using reverse vaccinology method: an in-silico approachMd Hasan Jafre Shovon, Md Imtiaz, Partha Biswas, et al.
In Silico Pharmacology|November 29, 2024
Targeting telomeric RNA quadruplexes with natural metabolites to prevent cancerGourav Choudhir, Sushil Kumar, Anuj Kumar
In Silico Pharmacology|November 25, 2024
Investigating the antibacterial potential of thiophene derivatives against wound infections: a combined DFT, molecular docking, and ADMET study targeting Staphylococcus aureus, Pseudomonas aeruginosa, and Escherichia coli resistant genesMathias O Ajaba, Bassey E Agbo, Nse Umoh, et al.
In Silico Pharmacology|November 21, 2024
Bioactive compounds from fermented Vernonia amygdalina leaf: Potent antibiotics against multidrug-resistant Escherichia coli and Salmonella typhiAdeleke Kazeem Atunnise, Ibukun Temitope Sossou, Peace Sekani Peters, et al.
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