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相关论文: Introduction to protein folding for physicists

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Many aspects of the study of protein folding and dynamics have been affected by the recent advances in machine learning. Methods for the prediction of protein structures from their sequences are now heavily based on machine learning tools.…

生物物理 · 物理学 2019-11-25 Frank Noé , Gianni De Fabritiis , Cecilia Clementi

A geometric analysis of protein folding, which complements many of the models in the literature, is presented. We examine the process from unfolded strand to the point where the strand becomes self-interacting. A central question is how it…

数学物理 · 物理学 2008-09-13 Walter A. Simmons , Joel L. Weiner

The intricate three-dimensional geometries of protein tertiary structures underlie protein function and emerge through a folding process from one-dimensional chains of amino acids. The exact spatial sequence and configuration of amino…

生物大分子 · 定量生物学 2021-02-24 Nora Molkenthin , Steffen Mühle , Antonia S J S Mey , Marc Timme

Understanding protein folding has been one of the great challenges in biochemistry and molecular biophysics. Over the past 50 years, many thermodynamic and kinetic studies have been performed addressing the stability of globular proteins.…

生物大分子 · 定量生物学 2014-04-01 Ernesto A. Roman , F. Luis Gonzalez Flecha

Natural protein sequences somehow encode the structural forms that these molecules adopt. Recent developments in structure-prediction are agnostic to the mechanisms by which proteins fold and represent them as static objects. However, the…

生物大分子 · 定量生物学 2025-05-26 Ezequiel A. Galpern , Federico Caamaño , Diego U. Ferreiro

The protein folding problem is stated and a list of properties that do not depend upon specific molecules is compiled and analyzed. The relationship of this analysis to future simulations is emphasized. The choice of power and time as…

生物物理 · 物理学 2017-09-26 Walter A. Simmons

While all the information required for the folding of a protein is contained in its amino acid sequence, one has not yet learned how to extract this information to predict the three--dimensional, biologically active, native conformation of…

生物大分子 · 定量生物学 2009-11-10 R. A. Broglia , G. Tiana

Protein folding is one of the age-old biological problems that refers to the mechanism of understanding and predicting how a protein's linear sequence of amino acids folds into its specific three dimensional structure.This structure is…

In the course of evolution, proteins undergo important changes in their amino acid sequences, while their three-dimensional folded structure and their biological function remain remarkably conserved. Thanks to modern sequencing techniques,…

生物大分子 · 定量生物学 2019-10-07 Simona Cocco , Christoph Feinauer , Matteo Figliuzzi , Remi Monasson , Martin Weigt

As protein folding is a NP-complete problem, artificial intelligence tools like neural networks and genetic algorithms are used to attempt to predict the 3D shape of an amino acids sequence. Underlying these attempts, it is supposed that…

生物大分子 · 定量生物学 2015-11-03 Jacques M. Bahi , Nathalie M. -L. Cote , Christophe Guyeux

RNA molecules are essential cellular machines performing a wide variety of functions for which a specific three-dimensional structure is required. Over the last several years, experimental determination of RNA structures through X-ray…

生物大分子 · 定量生物学 2015-06-11 Tristan Cragnolini , Philippe Derreumaux , Samuela Pasquali

To determine the 3D conformation of proteins is a necessity to understand their functions or interactions with other molecules. It is commonly admitted that, when proteins fold from their primary linear structures to their final 3D…

生物大分子 · 定量生物学 2013-06-07 Jacques M. Bahi , Wojciech Bienia , Nathalie Côté , Christophe Guyeux

Proteins are intricate molecular machines whose complexity arises from the heterogeneity of the amino acid building blocks and their dynamic network of many-body interactions. These nanomachines gain function when put in the context of a…

生物大分子 · 定量生物学 2023-12-14 John M. McBride , Tsvi Tlusty

Proteins are a matter of dual nature. As a physical object, a protein molecule is a folded chain of amino acids with multifarious biochemistry. But it is also an instantiation along an evolutionary trajectory determined by the function…

生物大分子 · 定量生物学 2019-09-04 Jean-Pierre Eckmann , Jacques Rougemont , Tsvi Tlusty

Natural protein molecules are exceptional polymers. Encoded in apparently random strings of amino-acids, these objects perform clear physical tasks that are rare to find by simple chance. Accurate folding, specific binding, powerful…

生物大分子 · 定量生物学 2017-10-09 Diego U. Ferreiro , Elizabeth A. Komives , Peter G. Wolynes

Making use of a simplified model for protein folding, it can be shown that conformations which are particularly stable when their energy is minimized with respect to amino acid sequence (in the sense that they display a large energy gap to…

软凝聚态物质 · 物理学 2007-05-23 R. A. Broglia , G. Tiana , H. E. Roman

Accurate physical modeling with 3D-printing techniques could lead to new approaches to study structure and dynamics of biological systems complementing computational methods. Computational biology has become an important part of research…

其他计算机科学 · 计算机科学 2015-07-14 Promita Chakraborty

This paper presents a method of reconstruction a primary structure of a protein that folds into a given geometrical shape. This method predicts the primary structure of a protein and restores its linear sequence of amino acids in the…

定量方法 · 定量生物学 2017-01-04 Andrii Riazanov , Mikhail Karasikov , Sergei Grudinin

The principles underlying protein folding remains one of Nature's puzzles with important practical consequences for Life. An approach that has gathered momentum since the late 1990's, looks at protein hetero-polymers and their folding…

计算工程、金融与科学 · 计算机科学 2011-10-05 Susan Khor

Predicting the three-dimensional (3D) functional structures of proteins remains an important computational milestone in molecular biology to be achieved. This feat is hinged on a clear understanding of the mechanism which proteins use to…

生物大分子 · 定量生物学 2019-11-28 Samuel Nkrumah