32 citations · 33 across the 3 of their papers we have counts for
3 papers
A Scalable, Linear-Time Dynamic Cutoff Algorithm for Molecular Dynamics
Paul Springer, Ahmed E. Ismail, Paolo Bientinesi
Recent results on supercomputers show that beyond 65K cores, the efficiency of molecular dynamics simulations of interfacial systems decreases significantly. In this paper, we intr…
Accelerating scientific codes by performance and accuracy modeling
Diego Fabregat-Traver, Ahmed E. Ismail, Paolo Bientinesi
Scientific software is often driven by multiple parameters that affect both accuracy and performance. Since finding the optimal configuration of these parameters is a highly comple…
Coating thickness and coverage effects on the forces between silica nanoparticles in water
K. Michael Salerno, Ahmed E. Ismail, J. Matthew D. Lane +1
The structure and interactions of coated silica nanoparticles have been studied in water using molecular dynamics simulations. For 5 nm diameter amorphous silica nanoparticles we s…