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This research demonstrates how transformers can be optimized via synthetic data shaping to solve symbolic regression, enabling faster and more robust discovery of physics formulae with superior extrapolation capabilities. By addressing overfitting inherent in existing models, the approach offers a significant speed advantage over traditional search-based methods while maintaining high accuracy on scientific benchmarks.
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Synthesizing Physics Formulae with Transformers

arXiv2 min read

arXiv:2610.03947v1 Announce Type: new Abstract: Finding a compact formula that fits a set of input-output pairs and predicts outputs on unseen inputs is a fundamental problem in science. Symbolic regression automates the search for such formulae: search-based methods explore the space of possible formulae directly, while transformers pre-trained on synthetic data produce formulae of comparable quality substantially faster. Existing transformers, however, are prone to overfitting --- they find formulae that fit the training data well but do not extrapolate to input ranges unseen during training. We address this by shaping the set of formulae used to train a transformer, and show that the resulting formulae extrapolate substantially better. Fine-tuning the transformer on data with noise-corrupted target values further makes the synthesized formulae robust to noise in the observations. On SRBench and LLM-SRBench our transformer synthesizes a formula in about ten seconds and extrapolates better than all evaluated methods at a comparable budget. Search-based methods surpass our accuracy only when given one to three orders of magnitude more time.

Abstract:Finding a compact formula that fits a set of input-output pairs and predicts outputs on unseen inputs is a fundamental problem in science. Symbolic regression automates the search for such formulae: search-based methods explore the space of possible formulae directly, while transformers pre-trained on synthetic data produce formulae of comparable quality substantially faster. Existing transformers, however, are prone to overfitting --- they find formulae that fit the training data well but do not extrapolate to input ranges unseen during training. We address this by shaping the set of formulae used to train a transformer, and show that the resulting formulae extrapolate substantially better. Fine-tuning the transformer on data with noise-corrupted target values further makes the synthesized formulae robust to noise in the observations. On SRBench and LLM-SRBench our transformer synthesizes a formula in about ten seconds and extrapolates better than all evaluated methods at a comparable budget. Search-based methods surpass our accuracy only when given one to three orders of magnitude more time.

Machine Learning (cs.LG); Symbolic Computation (cs.SC)

arXiv:2610.03947 [cs.LG]

(or arXiv:2610.03947v1 [cs.LG] for this version)

https://doi.org/10.48550/arXiv.2610.03947 Focus to learn more arXiv-issued DOI via DataCite (pending registration)

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Full text under the publisher's open licence · 260 words

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