An Ensemble Spectral Prediction (ESP) model for metabolite annotation.
Xinmeng LiYan Zhou ChenApurva KaliaHao ZhuLi-Ping LiuSoha HassounPublished in: Bioinformatics (Oxford, England) (2024)
The ESP code, a trained model, and a Jupyter notebook that guide users on using the ESP tool is available at https://github.com/HassounLab/ESP.