Article 3PDEW Let’s Talk Exascale: Thom Dunning on Molecular Modeling with NWCHEMEX

Let’s Talk Exascale: Thom Dunning on Molecular Modeling with NWCHEMEX

by
staff
from High-Performance Computing News Analysis | insideHPC on (#3PDEW)
thom-150x150.jpg

In this edition of Let's Talk Exascale, Thom Dunning from the University of Washington describes the software effort underway to for molecular modeling at exascale with NWCHEMEX. "To date, our work is focused on the redesign of Northwest Chem, but we've also explored a number of alternate strategies for implementing the overall redesign as well as the redesign of the algorithms, and this work required access to the ECP computing allocations."

The post Let's Talk Exascale: Thom Dunning on Molecular Modeling with NWCHEMEX appeared first on insideHPC.

External Content
Source RSS or Atom Feed
Feed Location http://insidehpc.com/feed/
Feed Title High-Performance Computing News Analysis | insideHPC
Feed Link https://insidehpc.com/
Reply 0 comments