The Role of the Dielectric Barrier in Narrow Biological Channels: A Novel Composite Approach to Modeling Single-Channel Currents

A Second Generation Force Field for the Simulation of Proteins, Nucleic Acids, and Organic Molecules

Wendy D. Cornell, Piotr Cieplak, Christopher I. Bayly et al. · Journal of the American Chemical Society · 1995 · 13.1K citations

Ionic channels of excitable membranes

General Pharmacology The Vascular System · 1985 · 7K citations

Membrane Transport, Physiology, Ion Channels +6

The Structure of the Potassium Channel: Molecular Basis of K ⁺ Conduction and Selectivity

D. Doyle, João H. Morais‐Cabral, Richard A. Pfuetzner et al. · Science · 1998 · 6.8K citations

Calculating Structures and Free Energies of Complex Molecules:  Combining Molecular Mechanics and Continuum Models

Peter A. Kollman, Irina Massova, Carolina Reyes et al. · Accounts of Chemical Research · 2000 · 4.8K citations

Ion-water interaction potentials derived from free energy perturbation simulations

Johan Åqvist · The Journal of Physical Chemistry · 1990 · 1.6K citations

Engineering, Chemical Analysis, Altmetric Attention Score +20