2 papers
q-bio.QM2019
AMPL: A Data-Driven Modeling Pipeline for Drug Discovery
Amanda J. Minnich, Kevin McLoughlin, Margaret Tse +9
One of the key requirements for incorporating machine learning into the drug discovery process is complete reproducibility and traceability of the model building and evaluation pro…
cs.AI2018
Precision Medicine as an Accelerator for Next Generation Cognitive Supercomputing
Edmon Begoli, Jim Brase, Bambi DeLaRosa +6
In the past several years, we have taken advantage of a number of opportunities to advance the intersection of next generation high-performance computing AI and big data technologi…