Handling ligands with Coot

Coot is a molecular-graphics application primarily aimed to assist in model building and validation of biological macromolecules. Recently, tools have been added to work with small molecules. The newly incorporated tools for the manipulation and validation of ligands include interaction with PRODRG,...

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Detalles Bibliográficos
Autores principales: Debreczeni, Judit É., Emsley, Paul
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
Materias:
Research Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3322601/
https://www.ncbi.nlm.nih.gov/pubmed/22505262
http://dx.doi.org/10.1107/S0907444912000200
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author Debreczeni, Judit É.
Emsley, Paul
author_facet Debreczeni, Judit É.
Emsley, Paul
author_sort Debreczeni, Judit É.
collection PubMed
description Coot is a molecular-graphics application primarily aimed to assist in model building and validation of biological macromolecules. Recently, tools have been added to work with small molecules. The newly incorporated tools for the manipulation and validation of ligands include interaction with PRODRG, subgraph isomorphism-based tools, representation of ligand chemistry, ligand fitting and analysis, and are described here.
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spelling pubmed-33226012012-04-16 Handling ligands with Coot Debreczeni, Judit É. Emsley, Paul Acta Crystallogr D Biol Crystallogr Research Papers Coot is a molecular-graphics application primarily aimed to assist in model building and validation of biological macromolecules. Recently, tools have been added to work with small molecules. The newly incorporated tools for the manipulation and validation of ligands include interaction with PRODRG, subgraph isomorphism-based tools, representation of ligand chemistry, ligand fitting and analysis, and are described here. International Union of Crystallography 2012-04-01 2012-03-16 /pmc/articles/PMC3322601/ /pubmed/22505262 http://dx.doi.org/10.1107/S0907444912000200 Text en © Debreczeni & Emsley 2012 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.
spellingShingle Research Papers
Debreczeni, Judit É.
Emsley, Paul
Handling ligands with Coot
title Handling ligands with Coot
title_full Handling ligands with Coot
title_fullStr Handling ligands with Coot
title_full_unstemmed Handling ligands with Coot
title_short Handling ligands with Coot
title_sort handling ligands with coot
topic Research Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3322601/
https://www.ncbi.nlm.nih.gov/pubmed/22505262
http://dx.doi.org/10.1107/S0907444912000200
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