Beyond Attention: Signed Integrated Gradients Attribution in a BiomeGPT-Style Microbiome Transformer
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Computer Science > Machine Learning
Title:Beyond Attention: Signed Integrated Gradients Attribution in a BiomeGPT-Style Microbiome Transformer
Abstract:In a feature-tokenized transformer (arXiv:2106.11959) such as BiomeGPT (doi:https://doi.org/10.64898/2026.01.05.697599), each input token is built by fusing a fixed identity with a sample-specific measurement: a fixed species and a variable abundance, T = S + A. To interpret downstream classification in such models, prior work inspects the attention weights of the special [CLS] token (arXiv:2106.11959, arXiv:1810.04805, BiomeGPT) to rank sample tokens by importance. These weights have two critical limitations: they are nonnegative, so they cannot separate disease-supporting from health-supporting evidence (arXiv:2201.12114), and they act after token fusion, obscuring how the input sources S and A each affect the output.
To address this we use Integrated Gradients (arXiv:1703.01365), a signed, fusion-aware attribution method, and propose a source-derived baseline T' = S + A_0 for feature-tokenized models such as BiomeGPT, which preserves species identity as a fixed biological coordinate while isolating the effect of abundance variation. Applied to a disease-versus-health decision margin, it yields polarity that explicitly separates pathogenic from protective microbial signals. We show that this gradient-based approach uncovers species-abundance directional relationships and sensitivity diagnostics entirely obscured by unsigned [CLS] attention weights. We further recommend second-order Integrated Hessians (arXiv:2002.04138) to expose microbiome community interaction rules: how a perturbation in one member alters the model's sensitivity to another, and which other species drive ambiguous cases toward disease or health at a given abundance level. This provides a principled approach to explainability in BiomeGPT that generalizes to other smooth and differentiable feature-tokenized transformers. Code is available at this https URL
| Comments: | 15 pages, 6 figures. Code: this https URL |
| Subjects: | Machine Learning (cs.LG) |
| Cite as: | arXiv:2608.06486 [cs.LG] |
| (or arXiv:2608.06486v1 [cs.LG] for this version) | |
| https://doi.org/10.48550/arXiv.2608.06486
arXiv-issued DOI via DataCite (pending registration)
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