We propose an application specific processor for computational quantum chemistry. The kernel of interest is the computation of electron repulsion integrals (ERIs), which vary in c...
Tirath Ramdas, Gregory K. Egan, David Abramson, Ki...
One of the primary goals in discovery science is to understand the human scientific reasoning processes. Despite sporadic success of automated discovery systems, few studies have s...
As part of a NASA HPCC Grand Challenge project, we are designing and implementing a parallel atmospheric chemical tracer model that will be suitable for use in global simulations....
Symmetry is a widespread phenomenon that can offer opportunities for powerful exploitation in areas as diverse as molecular chemistry, pure mathematics, circuit design, biology an...
We present PlasmidPL, a plasmid-inspired programming language designed for Genetic Programming (GP), and based on a chemical metaphor. The basic data structures in PlasmidPL are ci...