DCFold: Efficient Protein Structure Generation with Single Forward Pass

Fuente: arXiv
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Auteurs principaux: Zhang, Zhe, Feng, Yuanning, Song, Yuxuan, Qiu, Keyue, Zhou, Hao, Ma, Wei-Ying
Format: Preprint
Publié: 2026
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author Zhang, Zhe
Feng, Yuanning
Song, Yuxuan
Qiu, Keyue
Zhou, Hao
Ma, Wei-Ying
author_facet Zhang, Zhe
Feng, Yuanning
Song, Yuxuan
Qiu, Keyue
Zhou, Hao
Ma, Wei-Ying
contents AlphaFold3 introduces a diffusion-based architecture that elevates protein structure prediction to all-atom resolution with improved accuracy. This state-of-the-art performance has established AlphaFold3 as a foundation model for diverse generation and design tasks. However, its iterative design substantially increases inference time, limiting practical deployment in downstream settings such as virtual screening and protein design. We propose DCFold, a single-step generative model that attains AlphaFold3-level accuracy. Our Dual Consistency training framework, which incorporates a novel Temporal Geodesic Matching (TGM) scheduler, enables DCFold to achieve a 15x acceleration in inference while maintaining predictive fidelity. We validate its effectiveness across both structure prediction and binder design benchmarks.
format Preprint
id arxiv_https___arxiv_org_abs_2605_17899
institution arXiv
publishDate 2026
record_format arxiv
spellingShingle DCFold: Efficient Protein Structure Generation with Single Forward Pass
Zhang, Zhe
Feng, Yuanning
Song, Yuxuan
Qiu, Keyue
Zhou, Hao
Ma, Wei-Ying
Machine Learning
Artificial Intelligence
Quantitative Methods
AlphaFold3 introduces a diffusion-based architecture that elevates protein structure prediction to all-atom resolution with improved accuracy. This state-of-the-art performance has established AlphaFold3 as a foundation model for diverse generation and design tasks. However, its iterative design substantially increases inference time, limiting practical deployment in downstream settings such as virtual screening and protein design. We propose DCFold, a single-step generative model that attains AlphaFold3-level accuracy. Our Dual Consistency training framework, which incorporates a novel Temporal Geodesic Matching (TGM) scheduler, enables DCFold to achieve a 15x acceleration in inference while maintaining predictive fidelity. We validate its effectiveness across both structure prediction and binder design benchmarks.
title DCFold: Efficient Protein Structure Generation with Single Forward Pass
topic Machine Learning
Artificial Intelligence
Quantitative Methods
url https://arxiv.org/abs/2605.17899