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In Silico Pharmacology|April 1, 2024
In vitro combination effects of plant-derived quercetin with synthetic bicalutamide on prostate cancer and normal cell lines: in silico comparisonMary Shobha Rani Inala, Kiranmayee Pamidimukkala
In Silico Pharmacology|August 17, 2023
RND pump inhibition: in-silico and in-vitro study by Eugenol on clinical strain of E. coli and P. aeruginosaElham Etesami Ashtiani, Zohreh Gholizadeh Siahmazgi, Mirsasan Mirpour, et al.
In Silico Pharmacology|August 14, 2023
Target validation and structure-based virtual screening to Discover potential lead molecules against the oncogenic NSD1 histone methyltransferaseZahid Rafiq Bhat, Anuj Gahlawat, Navneet Kumar, et al.
In Silico Pharmacology|December 5, 2023
Exploring the viral protease inhibitor space driven by consensus scoring-based virtual screeningMamona Mushtaq, Sehrish Naz, Sajda Ashraf, et al.
In Silico Pharmacology|November 23, 2023
Virtual screening of pyrazole derivatives of usnic acid as new class of anti-hyperglycemic agents against PPARγ agonistsMiah Roney, Abdul Rashid Issahaku, Mohd Fadhlizil Fasihi Mohd Aluwi
In Silico Pharmacology|March 14, 2024
GC-MS analysis, pharmacokinetic properties, molecular docking and dynamics simulation of bioactives from Curcumis maderaspatanus to target oral cancerRonisha Shankar Rao, Deepak Saravanan, Monisha Mohan
In Silico Pharmacology|February 8, 2024
In silico exploration of hypothetical proteins in Neisseria gonorrhoeae for identification of therapeutic targetsGunjan Lakhanpal, Harshita Tiwari, Monu Kumar Shukla, et al.
In Silico Pharmacology|February 8, 2024
Investigation of alpha amylase inhibitors from Bidens pilosa L. by in silico and in vitro studiesAkshay Galagali, Vishal S Patil, Kashinath Hiremath, et al.
In Silico Pharmacology|April 8, 2024
A molecular docking exploration of the large extracellular loop of tetraspanin CD81 with small moleculesChristian Bailly, Corentin Bedart, Gérard Vergoten
In Silico Pharmacology|February 19, 2024
Virtual screening of acetylcholinesterase inhibitors through pharmacophore-based 3D-QSAR modeling, ADMET, molecular docking, and MD simulation studiesHitesh Kumar, Ashok Kumar Datusalia, Gopal L Khatik
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