Macromolecular modeling with rosetta

R Das, D Baker - Annu. Rev. Biochem., 2008 - annualreviews.org
Advances over the past few years have begun to enable prediction and design of
macromolecular structures at near-atomic accuracy. Progress has stemmed from the …

Machine learning methods for protein structure prediction

J Cheng, AN Tegge, P Baldi - IEEE reviews in biomedical …, 2008 - ieeexplore.ieee.org
Machine learning methods are widely used in bioinformatics and computational and
systems biology. Here, we review the development of machine learning methods for protein …

Critical assessment of methods of protein structure prediction (CASP)—Round XII

J Moult, K Fidelis, A Kryshtafovych… - Proteins: Structure …, 2018 - Wiley Online Library
This article reports the outcome of the 12th round of Critical Assessment of Structure
Prediction (CASP12), held in 2016. CASP is a community experiment to determine the state …

Automated comparative protein structure modeling with SWISS‐MODEL and Swiss‐PdbViewer: A historical perspective

N Guex, MC Peitsch, T Schwede - Electrophoresis, 2009 - Wiley Online Library
SWISS‐MODEL pioneered the field of automated modeling as the first protein modeling
service on the Internet. In combination with the visualization tool Swiss‐PdbViewer, the …

I-TASSER server for protein 3D structure prediction

Y Zhang - BMC bioinformatics, 2008 - Springer
Background Prediction of 3-dimensional protein structures from amino acid sequences
represents one of the most important problems in computational structural biology. The …

QMEAN server for protein model quality estimation

P Benkert, M Künzli, T Schwede - Nucleic acids research, 2009 - academic.oup.com
Abstract Model quality estimation is an essential component of protein structure prediction,
since ultimately the accuracy of a model determines its usefulness for specific applications …

New prediction categories in CASP15

A Kryshtafovych, M Antczak… - Proteins: Structure …, 2023 - Wiley Online Library
Prediction categories in the Critical Assessment of Structure Prediction (CASP) experiments
change with the need to address specific problems in structure modeling. In CASP15, four …

GraphQA: protein model quality assessment using graph convolutional networks

F Baldassarre, D Menéndez Hurtado, A Elofsson… - …, 2021 - academic.oup.com
Motivation Proteins are ubiquitous molecules whose function in biological processes is
determined by their 3D structure. Experimental identification of a protein's structure can be …

Critical assessment of methods of protein structure prediction: Progress and new directions in round XI

J Moult, K Fidelis, A Kryshtafovych… - Proteins: Structure …, 2016 - Wiley Online Library
Modeling of protein structure from amino acid sequence now plays a major role in structural
biology. Here we report new developments and progress from the CASP11 community …

Improved model quality assessment using ProQ2

A Ray, E Lindahl, B Wallner - BMC bioinformatics, 2012 - Springer
Background Employing methods to assess the quality of modeled protein structures is now
standard practice in bioinformatics. In a broad sense, the techniques can be divided into …