papers
Publications (4)
cs.LG2023
Multi-scale Sinusoidal Embeddings Enable Learning on High Resolution Mass Spectrometry Data
Gennady Voronov, Rose Lightheart, Joe Davison +3
cs.LG2023
Efficiently predicting high resolution mass spectra with graph neural networks
Michael Murphy, Stefanie Jegelka, Ernest Fraenkel +3
eess.SY2022
The role of living laboratories in unlocking the potential of low-carbon energy technologies on the journey to net-zero
Zhong Fan, Jun Cao, Taskin Jamal +8
cs.LG2026
MassSpecGym in the Wild: Uncovering and Correcting Evaluation Pitfalls in AI-Driven Molecule Discovery
Hongxuan Liu, Roman Bushuiev, Ivy Lightheart +12