David S Palmer

Multisolvent Models for Solvation Free Energy Predictions Using 3D-RISM Hydration Thermodynamic Descriptors

Vigneshwari Subramanian, Maxim V Fedorov, Ola Engkvist, 2020, J. Chem. Inf. Model..

Comparative Molecular Field Analysis Using Molecular Integral Equation Theory

David S Palmer, Samiul M Ansari, David S. Palmer, 2018, J. Chem. Inf. Model..

3D matters! 3D-RISM and 3D convolutional neural network for accurate bioaccumulation prediction

Sergey Sosnin, Maxim V Fedorov, David S Palmer, 2018, Journal of physics. Condensed matter : an Institute of Physics journal.

Exploring Ligand Stability in Protein Crystal Structures Using Binding Pose Metadynamics

David S Palmer, Lucia Fusani, Ian Wall, 2020, J. Chem. Inf. Model..

Harmonic Vibrational Analysis in Delocalized Internal Coordinates.

Frank Jensen, David S Palmer, 2011, Journal of chemical theory and computation.