David A. Demeter

Publication Activity (10 Years)

Years Active: 1998-2024
Publications (10 Years): 1

Top Topics

Random Sampling

Active Learning

Top Venues

J. Comput. Aided Mol. Des.

Publications

Ann E. Cleves, Ajay N. Jain, David A. Demeter, Zachary A. Buchan, Jeremy Wilmot, Erin N. Hancock
From UK-2A to florylpicoxamid: Active learning to identify a mimic of a macrocyclic natural product. J. Comput. Aided Mol. Des. 38 (1) (2024)
David A. Demeter, Herschel J. R. Weintraub, James J. Knittel
The Local Minima Method (LMM) of Pharmacophore Determination: A Protocol for Predicting the Bioactive Conformation of Small, Conformationally Flexible Molecules. J. Chem. Inf. Comput. Sci. 38 (6) (1998)