Michael P. Mazanetz

Prediction of cyclin-dependent kinase 2 inhibitor potency using the fragment molecular orbital method

Michael P. Mazanetz, Osamu Ichihara, Richard Law et al. · Journal of Cheminformatics · 2011 · 111 citations · Full text

Evaluation of water displacement energetics in protein binding sites with grid cell theory

Georgios Gerogiokas, Michelle Southey, Michael P. Mazanetz et al. · Physical Chemistry Chemical Physics · 2015 · 29 citations · Full text

Active Site Pressurization: A New Tool for Structure-Guided Drug Design and Other Studies of Protein Flexibility

Ian M. Withers, Michael P. Mazanetz, Hao Wang et al. · Journal of Chemical Information and Modeling · 2008 · 23 citations

Protein Assembly, Biomolecular Structure Prediction, Molecular Biology +22

Evaluation of Host–Guest Binding Thermodynamics of Model Cavities with Grid Cell Theory

Julien Michel, Richard H. Henchman, Georgios Gerogiokas et al. · Journal of Chemical Theory and Computation · 2014 · 23 citations · Full text

Drug Discovery Applications for KNIME: An Open Source Data Mining Platform

Michael P. Mazanetz, Catherine B. T. Reisser, Robert J. Marmon et al. · Current Topics in Medicinal Chemistry · 2013 · 20 citations

Data Mining Requirements, Drug Target, Engineering +20