SALSA: Semantically-Aware Latent Space Autoencoder. - Kathryn E. Kirchoff; Travis Maxfield; Alexander Tropsha; Shawn M. Gomez (AAAI, 2024)

Utilizing Low-Dimensional Molecular Embeddings for Rapid Chemical Similarity Search. - Kathryn E. Kirchoff; James Wellnitz; Joshua E. Hochuli; Travis Maxfield; Konstantin I. Popov; Shawn M. Gomez; Alexander Tropsha (ECIR (2), 2024)

One size does not fit all: revising traditional paradigms for assessing accuracy of QSAR models used for virtual screening. - James Wellnitz; Sankalp Jain; Joshua E. Hochuli; Travis Maxfield; Eugene N. Muratov; Alexander Tropsha; Alexey V. Zakharov (J. Cheminformatics, 2025)