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Publications by J. Peter Guthrie
FreeSolv: A Database of Experimental and Calculated Hydration Free Energies, With Input Files
Journal of Computer-Aided Molecular Design
Theoretical Chemistry
Drug Discovery
Computer Science Applications
Physical
Aggregation Ofp-Nitrophenyl Alkanoates in Aqueous Solution. Limitations on Their Use as Substrates in Enzyme Model Studies
Canadian Journal of Chemistry
Organic Chemistry
Catalysis
Chemistry
Related publications
Ab Initio Molecular Dynamics Calculations of Ion Hydration Free Energies
Journal of Chemical Physics
Medicine
Theoretical Chemistry
Astronomy
Physics
Physical
Free Energies of Hydration for Metal Ions From Heats of Vaporization
Communication: Accurate Hydration Free Energies at a Wide Range of Temperatures From 3d-Rism
Journal of Chemical Physics
Medicine
Theoretical Chemistry
Astronomy
Physics
Physical
Hydration Energies of Protonated and Sodiated Thiouracils
Journal of the American Society for Mass Spectrometry
Structural Biology
Spectroscopy
Relative Ligand-Binding Free Energies Calculated From Multiple Short QM/MM MD Simulations
Journal of Chemical Theory and Computation
Theoretical Chemistry
Computer Science Applications
Physical
DATABASE: Coral Case Files
Science
Multidisciplinary
Philosophy of Science
History
Protein-Solvent Attractive Interactions Dominate the Inverse Temperature Dependence of Polypeptide Hydration Free Energies
Biophysical Journal
Biophysics
Experimental Densities and Calculated Fractional Free Volumes of Ionic Liquids With Tri- And Tetra-Substituted Imidazolium Cations
Accuracy Enhancement in the Estimation of Molecular Hydration Free Energies by Implementing the Intramolecular Hydrogen Bond Effects
Journal of Cheminformatics
Computer Graphics
Information Sciences
Library
Theoretical Chemistry
Computer Science Applications
Computer-Aided Design
Physical
