Browsing by Author "Jana, K."
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- Designed inhibitors with hetero linkers for gastric proton pump H+,K+-ATPase: Steered molecular dynamics and metadynamics studies(2017) Jana, K.; Bandyopadhyay, T.; Ganguly, B.
- Probing the Role of Imidazopyridine and Imidazophosphorine Scaffolds To Design Novel Proton Pump Inhibitor for H+,K+-ATPase: A DFT Study(2019) Jana, K.; Ghosh, S.; Wakchaure, P. D.; Bandyopadhyay, T.; Ganguly, B.
- Revealing the Mechanistic Pathway of Acid Activation of Proton Pump Inhibitors To Inhibit the Gastric Proton Pump: A DFT Study(2016) Jana, K.; Bandyopadhyay, T.; Ganguly, B.
- Role of Noncovalent Interactions in Designing Inhibitors for H+,K+-ATPase: Combined QM and MD Based Investigations(2016) Jana, K.; Chandar, N. B.; Bandyopadhyay, T.
- Stereoselective Metabolism of Omeprazole by Cytochrome P450 2C19 and 3A4: Mechanistic Insights from DFT Study(2018) Jana, K.; Bandyopadhyay, T.; Ganguly, B.