Designed inhibitors with hetero linkers for gastric proton pump H+,K+-ATPase: Steered molecular dynamics and metadynamics studies

Jana, K.Bandyopadhyay, T.Ganguly, B.2018-03-122018-03-122017Journal of Molecular Graphics and Modelling, 2017. Vol. 78: pp. 129-138http://hdl.handle.net/123456789/157746022 bytestext/htmlenGastric proton pumpHetero-linkerNoncovalent interactionSteered molecular dynamics and well-tempered metadynamicsDesigned inhibitors with hetero linkers for gastric proton pump H+,K+-ATPase: Steered molecular dynamics and metadynamics studiesArticle