Graphormer-RT Fine-tuned Weights (HILIC)

These weights are for Graphormer-RT and were fine-tuned from the original weights for improved HILIC performance. The original model was developed by Cailum M. K. Stienstra, Emir Nazdrajić, and W. Scott Hopkins, as described in: “From Reverse Phase Chromatography to HILIC: Graph Transformers Power Method-Independent Machine Learning of Retention Times,” published in Analytical Chemistry.Code for training and inference using these weights is available in our repository: deep_metab.