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Autori principali: Abbaszadeh, Alireza, Shahlaee, Armita
Natura: Preprint
Pubblicazione: 2025
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Accesso online:https://arxiv.org/abs/2508.18446
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author Abbaszadeh, Alireza
Shahlaee, Armita
author_facet Abbaszadeh, Alireza
Shahlaee, Armita
contents AlphaFold 3 represents a transformative advancement in computational biology, enhancing protein structure prediction through novel multi-scale transformer architectures, biologically informed cross-attention mechanisms, and geometry-aware optimization strategies. These innovations dramatically improve predictive accuracy and generalization across diverse protein families, surpassing previous methods. Crucially, AlphaFold 3 embodies a paradigm shift toward differentiable simulation, bridging traditional static structural modeling with dynamic molecular simulations. By reframing protein folding predictions as a differentiable process, AlphaFold 3 serves as a foundational framework for integrating deep learning with physics-based molecular
format Preprint
id arxiv_https___arxiv_org_abs_2508_18446
institution arXiv
publishDate 2025
record_format arxiv
spellingShingle From Prediction to Simulation: AlphaFold 3 as a Differentiable Framework for Structural Biology
Abbaszadeh, Alireza
Shahlaee, Armita
Biomolecules
Machine Learning
AlphaFold 3 represents a transformative advancement in computational biology, enhancing protein structure prediction through novel multi-scale transformer architectures, biologically informed cross-attention mechanisms, and geometry-aware optimization strategies. These innovations dramatically improve predictive accuracy and generalization across diverse protein families, surpassing previous methods. Crucially, AlphaFold 3 embodies a paradigm shift toward differentiable simulation, bridging traditional static structural modeling with dynamic molecular simulations. By reframing protein folding predictions as a differentiable process, AlphaFold 3 serves as a foundational framework for integrating deep learning with physics-based molecular
title From Prediction to Simulation: AlphaFold 3 as a Differentiable Framework for Structural Biology
topic Biomolecules
Machine Learning
url https://arxiv.org/abs/2508.18446