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Publications by William L. Jorgensen

Quantum Mechanical/Molecular Mechanical Modeling Finds Diels−Alder Reactions Are Accelerated Less on the Surface of Water Than in Water

Journal of the American Chemical Society

Surface Chemistry

English

A Remote Arene-Binding Site on Prostate Specific Membrane Antigen Revealed by Antibody-Recruiting Small Molecules

Journal of the American Chemical Society

Surface Chemistry

English

Structure-Based Evaluation of Non-Nucleoside Inhibitors With Improved Potency and Solubility That Target HIV Reverse Transcriptase Variants

Journal of Medicinal Chemistry

Molecular Medicine

English

Methyl Effects on Protein–Ligand Binding

Journal of Medicinal Chemistry

Molecular Medicine

English

Investigation of Solvent Effects on the Rate and Stereoselectivity of the Henry Reaction

Organic Letters

Organic Chemistry

Theoretical Chemistry

English

Effects of Water Placement on Predictions of Binding Affinities for P38α MAP Kinase Inhibitors

Journal of Chemical Theory and Computation

Theoretical Chemistry

Computer Science Applications

English

Evaluation of CM5 Charges for Nonaqueous Condensed-Phase Modeling

Journal of Chemical Theory and Computation

Theoretical Chemistry

Computer Science Applications

English

Determination of Partial Molar Volumes From Free Energy Perturbation Theory

Physical Chemistry Chemical Physics

Theoretical Chemistry

English

Optimization of Pyrazoles as Phenol Surrogates to Yield Potent Inhibitors of Macrophage Migration Inhibitory Factor

Organic Chemistry

Molecular Medicine

English

Extension Into the Entrance Channel of HIV-1 Reverse Transcriptase—Crystallography and Enhanced Solubility

Bioorganic and Medicinal Chemistry Letters

Organic Chemistry

Molecular Medicine

Molecular Biology

Clinical Biochemistry

Pharmaceutical Science

English