David Scott Palmer

Random Forest Models To Predict Aqueous Solubility

David Scott Palmer, Noel M. O’Boyle, Robert C. Glen et al. · Journal of Chemical Information and Modeling · 2006 · 375 citations

Pharmacy, Chemistry, Computational Chemistry +16

Why Are Some Properties More Difficult To Predict than Others? A Study of QSPR Models of Solubility, Melting Point, and Log P

Laura D. Hughes, David Scott Palmer, Florian Nigsch et al. · Journal of Chemical Information and Modeling · 2008 · 219 citations

Pharmacy, Chemistry, Medicinal Chemistry +17

Development of high-throughput ATR-FTIR technology for rapid triage of brain cancer

Holly J. Butler, Paul M. Brennan, James M. Cameron et al. · Nature Communications · 2019 · 197 citations · Full text

Medicine, Biomedical Engineering, Oncology +12

Exploring Ligand Stability in Protein Crystal Structures Using Binding Pose Metadynamics

Lucia Fusani, David Scott Palmer, Don O. Somers et al. · Journal of Chemical Information and Modeling · 2020 · 144 citations · Full text

Pharmacy, Chemistry, Medicinal Chemistry +16

Towards a universal method for calculating hydration free energies: a 3D reference interaction site model with partial molar volume correction

David Scott Palmer, Andrey I. Frolov, Ekaterina L. Ratkova et al. · Journal of Physics Condensed Matter · 2010 · 142 citations

Natural Sciences, Chemistry, Physics +16