ASTRO-FOLD: a combinatorial and global optimization framework for Ab initio prediction of three-dimensional structures of proteins from the amino acid sequence.

Abstract:

:The field of computational biology has been revolutionized by recent advances in genomics. The completion of a number of genome projects, including that of the human genome, has paved the way toward a variety of challenges and opportunities in bioinformatics and biological systems engineering. One of the first challenges has been the determination of the structures of proteins encoded by the individual genes. This problem, which represents the progression from sequence to structure (genomics to structural genomics), has been widely known as the structure-prediction-in-protein-folding problem. We present the development and application of ASTRO-FOLD, a novel and complete approach for the ab initio prediction of protein structures given only the amino acid sequences of the proteins. The approach exhibits many novel components and the merits of its application are examined for a suite of protein systems, including a number of targets from several critical-assessment-of-structure-prediction experiments.

journal_name

Biophys J

journal_title

Biophysical journal

authors

Klepeis JL,Floudas CA

doi

10.1016/S0006-3495(03)74640-2

subject

Has Abstract

pub_date

2003-10-01 00:00:00

pages

2119-46

issue

4

eissn

0006-3495

issn

1542-0086

pii

S0006-3495(03)74640-2

journal_volume

85

pub_type

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