David S Cerutti

Staggered Mesh Ewald: An extension of the Smooth Particle-Mesh Ewald method adding great versatility.

Terry P Lybrand, David S Cerutti, Robert E Duke, 2009, Journal of chemical theory and computation.

A Fast Implementation of the Nudged Elastic Band Method in AMBER.

Carlos Simmerling, David S Cerutti, Delaram Ghoreishi, 2019, Journal of chemical theory and computation.

Multi-Level Ewald: A hybrid multigrid / Fast Fourier Transform approach to the electrostatic particle-mesh problem.

David S Cerutti, David A Case, D. Case, 2010, Journal of chemical theory and computation.

GPU-Accelerated Molecular Dynamics and Free Energy Methods in Amber18: Performance Enhancements and New Features

Tai-Sung Lee, Darrin M York, Charles Lin, 2018, J. Chem. Inf. Model..

Rapid Estimation of Solvation Energy for Simulations of Protein-Protein Association.

J Andrew McCammon, Lynn F Ten Eyck, David S Cerutti, 2005, Journal of chemical theory and computation.

Dynamics of the streptavidin-biotin complex in solution and in its crystal lattice: distinct behavior revealed by molecular simulations.

Terry P Lybrand, David S Cerutti, T. Lybrand, 2009, The journal of physical chemistry. B.

Peptide crystal simulations reveal hidden dynamics.

David S Cerutti, David A Case, James Holton, 2013, Journal of the American Chemical Society.

Configurational‐bias sampling technique for predicting side‐chain conformations in proteins

J Andrew McCammon, David S Cerutti, Tushar Jain, 2006, Protein science : a publication of the Protein Society.