18 citations · 30 across the 10 of their papers we have counts for
Showing 2020Show all
2 papers · 1 filter
physics.chem-ph2020
Exploring the impacts of conformer selection methods on ion mobility collision cross section predictions
Felicity F. Nielson, Sean M. Colby, Dennis G. Thomas +2
The prediction of structure dependent molecular properties, such as collision cross sections as measured using ion mobility spectrometry, are crucially dependent on the selection o…
q-bio.BM2020★ 18 cited
Application and Assessment of Deep Learning for the Generation of Potential NMDA Receptor Antagonists
Katherine J. Schultz, Sean M. Colby, Yasemin Yesiltepe +3
Uncompetitive antagonists of the N-methyl D-aspartate receptor (NMDAR) have demonstrated therapeutic benefit in the treatment of neurological diseases such as Parkinson's and Alzhe…