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Main Authors: Kang, Mingu, Lee, Dongseok, Cho, Woojin, Park, Jaehyeon, Lee, Kookjin, Gruber, Anthony, Hong, Youngjoon, Park, Noseong
Format: Preprint
Published: 2024
Subjects:
Online Access:https://arxiv.org/abs/2410.06442
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author Kang, Mingu
Lee, Dongseok
Cho, Woojin
Park, Jaehyeon
Lee, Kookjin
Gruber, Anthony
Hong, Youngjoon
Park, Noseong
author_facet Kang, Mingu
Lee, Dongseok
Cho, Woojin
Park, Jaehyeon
Lee, Kookjin
Gruber, Anthony
Hong, Youngjoon
Park, Noseong
contents Large language models (LLMs), like ChatGPT, have shown that even trained with noisy prior data, they can generalize effectively to new tasks through in-context learning (ICL) and pre-training techniques. Motivated by this, we explore whether a similar approach can be applied to scientific foundation models (SFMs). Our methodology is structured as follows: (i) we collect low-cost physics-informed neural network (PINN)-based approximated prior data in the form of solutions to partial differential equations (PDEs) constructed through an arbitrary linear combination of mathematical dictionaries; (ii) we utilize Transformer architectures with self and cross-attention mechanisms to predict PDE solutions without knowledge of the governing equations in a zero-shot setting; (iii) we provide experimental evidence on the one-dimensional convection-diffusion-reaction equation, which demonstrate that pre-training remains robust even with approximated prior data, with only marginal impacts on test accuracy. Notably, this finding opens the path to pre-training SFMs with realistic, low-cost data instead of (or in conjunction with) numerical high-cost data. These results support the conjecture that SFMs can improve in a manner similar to LLMs, where fully cleaning the vast set of sentences crawled from the Internet is nearly impossible.
format Preprint
id arxiv_https___arxiv_org_abs_2410_06442
institution arXiv
publishDate 2024
record_format arxiv
spellingShingle MaD-Scientist: AI-based Scientist solving Convection-Diffusion-Reaction Equations Using Massive PINN-Based Prior Data
Kang, Mingu
Lee, Dongseok
Cho, Woojin
Park, Jaehyeon
Lee, Kookjin
Gruber, Anthony
Hong, Youngjoon
Park, Noseong
Machine Learning
Artificial Intelligence
Large language models (LLMs), like ChatGPT, have shown that even trained with noisy prior data, they can generalize effectively to new tasks through in-context learning (ICL) and pre-training techniques. Motivated by this, we explore whether a similar approach can be applied to scientific foundation models (SFMs). Our methodology is structured as follows: (i) we collect low-cost physics-informed neural network (PINN)-based approximated prior data in the form of solutions to partial differential equations (PDEs) constructed through an arbitrary linear combination of mathematical dictionaries; (ii) we utilize Transformer architectures with self and cross-attention mechanisms to predict PDE solutions without knowledge of the governing equations in a zero-shot setting; (iii) we provide experimental evidence on the one-dimensional convection-diffusion-reaction equation, which demonstrate that pre-training remains robust even with approximated prior data, with only marginal impacts on test accuracy. Notably, this finding opens the path to pre-training SFMs with realistic, low-cost data instead of (or in conjunction with) numerical high-cost data. These results support the conjecture that SFMs can improve in a manner similar to LLMs, where fully cleaning the vast set of sentences crawled from the Internet is nearly impossible.
title MaD-Scientist: AI-based Scientist solving Convection-Diffusion-Reaction Equations Using Massive PINN-Based Prior Data
topic Machine Learning
Artificial Intelligence
url https://arxiv.org/abs/2410.06442