Growing ecosystem of deep learning methods for modeling protein$\unicode{x2013}$protein interactions

التفاصيل البيبلوغرافية
العنوان: Growing ecosystem of deep learning methods for modeling protein$\unicode{x2013}$protein interactions
المؤلفون: Rogers, Julia R., Nikolényi, Gergő, AlQuraishi, Mohammed
سنة النشر: 2023
المجموعة: Computer Science
Quantitative Biology
مصطلحات موضوعية: Quantitative Biology - Biomolecules, Computer Science - Machine Learning
الوصف: Numerous cellular functions rely on protein$\unicode{x2013}$protein interactions. Efforts to comprehensively characterize them remain challenged however by the diversity of molecular recognition mechanisms employed within the proteome. Deep learning has emerged as a promising approach for tackling this problem by exploiting both experimental data and basic biophysical knowledge about protein interactions. Here, we review the growing ecosystem of deep learning methods for modeling protein interactions, highlighting the diversity of these biophysically-informed models and their respective trade-offs. We discuss recent successes in using representation learning to capture complex features pertinent to predicting protein interactions and interaction sites, geometric deep learning to reason over protein structures and predict complex structures, and generative modeling to design de novo protein assemblies. We also outline some of the outstanding challenges and promising new directions. Opportunities abound to discover novel interactions, elucidate their physical mechanisms, and engineer binders to modulate their functions using deep learning and, ultimately, unravel how protein interactions orchestrate complex cellular behaviors.
Comment: 19 pages, added model names to discussion
نوع الوثيقة: Working Paper
URL الوصول: http://arxiv.org/abs/2310.06725
رقم الأكسشن: edsarx.2310.06725
قاعدة البيانات: arXiv