Michelle Lynn Hall
Schrodinger (United States)(US)
Publications by Year
Research Areas
Advanced Chemical Physics Studies, Organic Electronics and Photovoltaics, Computational Drug Discovery Methods, Asymmetric Hydrogenation and Catalysis, Catalysis and Oxidation Reactions
Most-Cited Works
- → Accurate Force Field Development for Modeling Conjugated Polymers(2012)135 cited
- → Quantitative DFT Modeling of the Enantiomeric Excess for Dioxirane-Catalyzed Epoxidations(2009)101 cited
- → Small Molecule-facilitated Degradation of ANO1 Protein(2014)83 cited
- → Relative Binding Free Energy Calculations Applied to Protein Homology Models(2016)75 cited
- → Automated Ligand- and Structure-Based Protocol for in Silico Prediction of Human Serum Albumin Binding(2013)50 cited
- → Using a Two-Step Hydride Transfer To Achieve 1,4-Reduction in the Catalytic Hydrogenation of an Acyl Pyridinium Cation(2008)36 cited
- → Localized Orbital Corrections for the Barrier Heights in Density Functional Theory(2009)25 cited
- → Polarized Raman Spectroscopy of Oligothiophene Crystals To Determine Unit Cell Orientation(2012)14 cited
- → Continuous Localized Orbital Corrections to Density Functional Theory: B3LYP-CLOC(2010)10 cited
- → The Chemical Tuning of a Weak Zinc Binding Motif for Histone Deacetylase Using Electronic Effects(2012)8 cited