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In Silico Pharmacology|December 22, 2025
Molecular docking and molecular dynamics study of PUFAs from Navicula salinicola: prospective antiviral strategies targeting the SARS-CoV-2 spike proteinAiyi Asnawi, Widhya Aligita, Ellin Febrina, et al.
In Silico Pharmacology|December 1, 2025
Thiuram disulfides as prospective inhibitors of 3-chymotrypsin-like cysteine protease: an in-silico approach targeting SARS-CoV-2Segun D Oladipo, Samuel O Olalekan, Vincent A Obakachi, et al.
In Silico Pharmacology|December 1, 2025
Computational discovery to reveal molecular interactions of phytochemicals with deadly snake venoms as potential therapeutic candidate for snakebite treatmentOm Kumar Das, Ashis Kumar Hial, Roman Kumar Aneshwari, et al.
In Silico Pharmacology|April 26, 2024
Identification of bio-active secondary metabolites from Actinobacteria as potential drug targets against Porphyromonas gingivalis in oral squamous cell carcinoma using molecular docking and dynamics studyZarin Taj, Indranil Chattopadhyay
In Silico Pharmacology|May 8, 2024
In silico investigation of cannabinoids from Cannabis sativa leaves as a potential anticancer drug to inhibit MAPK-ERK signaling pathway and EMT inductionShabnoor Iqbal, Motlalepula Matsabisa
In Silico Pharmacology|May 6, 2024
Comparative analyses of anti-inflammatory effects of Resveratrol, Pterostilbene and Curcumin: in-silico and in-vitro evidencesRashmi Patil, Gaurang Telang, Urmila Aswar, et al.
In Silico Pharmacology|April 15, 2024
Exploring the potential of 2-arylbenzimidazole scaffolds as novel α-amylase inhibitors: QSAR, molecular docking, simulation and pharmacokinetic studiesKhalifa Sunusi Aminu, Adamu Uzairu, Anshuman Chandra, et al.
In Silico Pharmacology|May 3, 2024
Strategic pathway analysis for dual management of epilepsy and comorbid depression: a systems biology perspectiveArvinder Kaur, Raji, Varinder Verma, et al.
In Silico Pharmacology|January 8, 2024
In silico analysis of virulence factors of Streptococcus uberis for a chimeric vaccine designÇiğdem Yılmaz Çolak
In Silico Pharmacology|December 22, 2023
Predicting Plasmodium falciparum kinase inhibitors from antimalarial medicinal herbs using computational modeling approachTemitope Isaac Adelusi, Taiwo Ooreoluwa Ojo, Olawale Quadri Bolaji, et al.
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