Kalyan Ghosh

Chemical-informatics approach to COVID-19 drug discovery: Monte Carlo based QSAR, virtual screening and molecular docking study of some <i>in-house</i> molecules as papain-like protease (PLpro) inhibitors

Sk. Abdul Amin, Kalyan Ghosh, Shovanlal Gayen et al. · Journal of Biomolecular Structure and Dynamics · 2020 · 112 citations · Full text

Pharmacy, Medicinal Chemistry, Pharmacology +17

Chemical-informatics approach to COVID-19 drug discovery: Exploration of important fragments and data mining based prediction of some hits from natural origins as main protease (Mpro) inhibitors

Kalyan Ghosh, Sk. Abdul Amin, Shovanlal Gayen et al. · Journal of Molecular Structure · 2020 · 65 citations · Full text

Pharmacy, Bioinformatics, Medicinal Chemistry +15

<i>In silico</i> modelling, identification of crucial molecular fingerprints, and prediction of new possible substrates of human organic cationic transporters 1 and 2

Anurag T. K. Baidya, Kalyan Ghosh, Sk. Abdul Amin et al. · New Journal of Chemistry · 2020 · 28 citations

Life Sciences, Biochemistry, Molecular Biology +10

Identification of structural fingerprints for ABCG2 inhibition by using Monte Carlo optimization, Bayesian classification, and structural and physicochemical interpretation (SPCI) analysis

Kalyan Ghosh, Bhagwati Bhardwaj, Sk. Abdul Amin et al. · SAR and QSAR in environmental research · 2020 · 15 citations

Pharmacy, Medicinal Chemistry, Pharmacology +17

Identification of molecular fingerprints of natural products for the inhibition of breast cancer resistance protein (BCRP)

Arghya Banik, Kalyan Ghosh, Umesh Kumar Patil et al. · Phytomedicine · 2021 · 15 citations

Medicine, Medicinal Chemistry, Pharmacology +14