Results 41 to 50 of about 1,677,396 (366)

De novo design of protein structure and function with RFdiffusion

open access: yesNature, 2023
There has been considerable recent progress in designing new proteins using deep-learning methods^ 1 – 9 . Despite this progress, a general deep-learning framework for protein design that enables solution of a wide range of design challenges, including ...
Joseph L. Watson   +27 more
semanticscholar   +1 more source

Protein secondary structure: Entropy, correlations and prediction [PDF]

open access: yes, 2003
Is protein secondary structure primarily determined by local interactions between residues closely spaced along the amino acid backbone, or by non-local tertiary interactions?
Brenner, Steven E., Crooks, Gavin E.
core   +6 more sources

Enhancing fragment-based protein structure prediction by customising fragment cardinality according to local secondary structure

open access: yesBMC Bioinformatics, 2020
Background Whenever suitable template structures are not available, usage of fragment-based protein structure prediction becomes the only practical alternative as pure ab initio techniques require massive computational resources even for very small ...
Jad Abbass, Jean-Christophe Nebel
doaj   +1 more source

Single-sequence protein structure prediction using supervised transformer protein language models

open access: yesbioRxiv, 2022
It remains challenging for single-sequence protein structure prediction with AlphaFold2 and other deep learning methods. In this work, we introduce trRosettaX-Single, a novel algorithm for singlesequence protein structure prediction.
Wenkai Wang, Zhenling Peng, Jianyi Yang
semanticscholar   +1 more source

Protein Structure Prediction [PDF]

open access: yes, 2009
Práce popisuje prostorovou strukturu molekul bílkovin a databází uchovávajících representace této struktury, či její hierarchické klasifikace. Je poskytnut přehled současných metod výpočetní predikce struktury bílkovin, přičemž největší pozornost je ...
Tuček, Jaroslav
core   +1 more source

High‐accuracy protein structure prediction in CASP14

open access: yesProteins: Structure, Function, and Bioinformatics, 2021
The application of state‐of‐the‐art deep‐learning approaches to the protein modeling problem has expanded the “high‐accuracy” category in CASP14 to encompass all targets.
J. Pereira   +5 more
semanticscholar   +1 more source

Structure Prediction of Membrane Proteins

open access: yesGenomics, Proteomics & Bioinformatics, 2004
Abstract There is a large gap between the number of membrane protein (MP) sequences and that of their decoded 3D structures, especially high-resolution structures, due to difficulties in crystal preparation of MPs. However, detailed knowledge of the 3D structure is required for the fundamental understanding of the function of an MP and ...
Chunlong Zhou, Yan Zhou, Yao Zheng
openaire   +3 more sources

Comparative Protein Structure Modeling Using MODELLER

open access: yesCurrent Protocols in Bioinformatics, 2016
Comparative protein structure modeling predicts the three‐dimensional structure of a given protein sequence (target) based primarily on its alignment to one or more proteins of known structure (templates).
Ben M. Webb, A. Sali
semanticscholar   +1 more source

Broadly applicable and accurate protein design by integrating structure prediction networks and diffusion generative models

open access: yesbioRxiv, 2022
There has been considerable recent progress in designing new proteins using deep learning methods1–9. Despite this progress, a general deep learning framework for protein design that enables solution of a wide range of design challenges, including de ...
Joseph L. Watson   +26 more
semanticscholar   +1 more source

The HHpred interactive server for protein homology detection and structure prediction

open access: yesNucleic Acids Res., 2005
HHpred is a fast server for remote protein homology detection and structure prediction and is the first to implement pairwise comparison of profile hidden Markov models (HMMs).
J. Söding, A. Biegert, A. Lupas
semanticscholar   +1 more source

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