A multi-feature graph attention network with adaptive focal loss reaches AUROC 0.9294 and F1 0.4632 on multi-label odor prediction from molecular structure.
Classifier Chain Networks for Multi-Label Classification
1 Pith paper cite this work. Polarity classification is still indexing.
abstract
The classifier chain is a widely used method for analyzing multi-labeled data sets. In this study, we introduce a generalization of the classifier chain: the classifier chain network. The classifier chain network enables joint estimation of model parameters, and allows to account for the influence of earlier label predictions on subsequent classifiers in the chain. Through simulations, we evaluate the classifier chain network's performance against multiple benchmark methods, demonstrating competitive results even in scenarios that deviate from its modeling assumptions. Furthermore, we propose a new measure for detecting conditional dependencies between labels and illustrate the classifier chain network's effectiveness using an empirical data set.
citation-role summary
citation-polarity summary
fields
cs.LG 1years
2025 1verdicts
CONDITIONAL 1roles
background 1polarities
background 1representative citing papers
citing papers explorer
-
Molecular Odor Prediction Based on Multi-Feature Graph Attention Networks
A multi-feature graph attention network with adaptive focal loss reaches AUROC 0.9294 and F1 0.4632 on multi-label odor prediction from molecular structure.