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EasyModel: a user-friendly web-based interface based on MODELLER

Three-dimensional protein structures are invaluable sources of information for the functional annotation of protein molecules. Describing the function of a protein sequence is one of the most common problems in biology. Generally, this problem can be facilitated by studying the tertiary structure of...

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Autores principales: Arab, Seyed Shahriar, Dantism, Alireza
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group UK 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10567746/
https://www.ncbi.nlm.nih.gov/pubmed/37821634
http://dx.doi.org/10.1038/s41598-023-44505-9
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author Arab, Seyed Shahriar
Dantism, Alireza
author_facet Arab, Seyed Shahriar
Dantism, Alireza
author_sort Arab, Seyed Shahriar
collection PubMed
description Three-dimensional protein structures are invaluable sources of information for the functional annotation of protein molecules. Describing the function of a protein sequence is one of the most common problems in biology. Generally, this problem can be facilitated by studying the tertiary structure of proteins. In the lack of protein structures, comparative modeling often provides a useful three-dimensional model of the protein associated with at least one known protein structure. Comparative modeling predicts the tertiary structure of a certain protein sequence (target) mainly based on its homological sequence to the sequence of one or more proteins with known structures (templates). MODELLER is one of the most widely used tools for homology or comparative modeling of three-dimensional protein structures. However, most users find it challenging to start with MODELLER as it is a command line based and requires knowledge of basic Python scripting to use it efficiently. In this study, a web-based interface has been designed to predict the tertiary structure of proteins based on Modeller, which does the comparative modeling automatically, and uses PHP and Python programming languages. This tool is called “EasyModel” and is available at http://bioinf.modares.ac.ir/software/easymodel/. EasyModel provides a straightforward graphical interface for Modeller that can be used in only one browser.
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spelling pubmed-105677462023-10-13 EasyModel: a user-friendly web-based interface based on MODELLER Arab, Seyed Shahriar Dantism, Alireza Sci Rep Article Three-dimensional protein structures are invaluable sources of information for the functional annotation of protein molecules. Describing the function of a protein sequence is one of the most common problems in biology. Generally, this problem can be facilitated by studying the tertiary structure of proteins. In the lack of protein structures, comparative modeling often provides a useful three-dimensional model of the protein associated with at least one known protein structure. Comparative modeling predicts the tertiary structure of a certain protein sequence (target) mainly based on its homological sequence to the sequence of one or more proteins with known structures (templates). MODELLER is one of the most widely used tools for homology or comparative modeling of three-dimensional protein structures. However, most users find it challenging to start with MODELLER as it is a command line based and requires knowledge of basic Python scripting to use it efficiently. In this study, a web-based interface has been designed to predict the tertiary structure of proteins based on Modeller, which does the comparative modeling automatically, and uses PHP and Python programming languages. This tool is called “EasyModel” and is available at http://bioinf.modares.ac.ir/software/easymodel/. EasyModel provides a straightforward graphical interface for Modeller that can be used in only one browser. Nature Publishing Group UK 2023-10-11 /pmc/articles/PMC10567746/ /pubmed/37821634 http://dx.doi.org/10.1038/s41598-023-44505-9 Text en © The Author(s) 2023 https://creativecommons.org/licenses/by/4.0/Open Access This article is licensed under a Creative Commons Attribution 4.0 International License, which permits use, sharing, adaptation, distribution and reproduction in any medium or format, as long as you give appropriate credit to the original author(s) and the source, provide a link to the Creative Commons licence, and indicate if changes were made. The images or other third party material in this article are included in the article’s Creative Commons licence, unless indicated otherwise in a credit line to the material. If material is not included in the article’s Creative Commons licence and your intended use is not permitted by statutory regulation or exceeds the permitted use, you will need to obtain permission directly from the copyright holder. To view a copy of this licence, visit http://creativecommons.org/licenses/by/4.0/ (https://creativecommons.org/licenses/by/4.0/) .
spellingShingle Article
Arab, Seyed Shahriar
Dantism, Alireza
EasyModel: a user-friendly web-based interface based on MODELLER
title EasyModel: a user-friendly web-based interface based on MODELLER
title_full EasyModel: a user-friendly web-based interface based on MODELLER
title_fullStr EasyModel: a user-friendly web-based interface based on MODELLER
title_full_unstemmed EasyModel: a user-friendly web-based interface based on MODELLER
title_short EasyModel: a user-friendly web-based interface based on MODELLER
title_sort easymodel: a user-friendly web-based interface based on modeller
topic Article
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10567746/
https://www.ncbi.nlm.nih.gov/pubmed/37821634
http://dx.doi.org/10.1038/s41598-023-44505-9
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