Polarizable Simulations with Second-Order Interaction Model (POSSIM) force field: Developing parameters for side-chain analogues

Calculating pKa values for substituted phenols and hydration energies for other compounds with the first-order fuzzy-border continuum solvation model

Importance of electrostatic polarizability in calculating cysteine acidity constants and copper(I) binding energy of Bacillus subtilis CopZ

Polarizable Simulations with Second-Order Interaction Model (POSSIM) Force Field: Developing Parameters for Alanine Peptides and Protein backbone

Electrostatic Polarization is Crucial in Reproducing Cu(I) Interaction Energies and Hydration

Reproducing Basic pK(a) values for Turkey Ovomucoid Third Domain Using a Poalrizable Force Field