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Visual automated macromolecular model building

Automated model-building software aims at the objective interpretation of crystallographic diffraction data by means of the construction or completion of macromolecular models. Automated methods have rapidly gained in popularity as they are easy to use and generate reproducible and consistent result...

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Detalles Bibliográficos
Autores principales: Langer, Gerrit G., Hazledine, Saul, Wiegels, Tim, Carolan, Ciaran, Lamzin, Victor S.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2013
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3606041/
https://www.ncbi.nlm.nih.gov/pubmed/23519672
http://dx.doi.org/10.1107/S0907444913000565
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author Langer, Gerrit G.
Hazledine, Saul
Wiegels, Tim
Carolan, Ciaran
Lamzin, Victor S.
author_facet Langer, Gerrit G.
Hazledine, Saul
Wiegels, Tim
Carolan, Ciaran
Lamzin, Victor S.
author_sort Langer, Gerrit G.
collection PubMed
description Automated model-building software aims at the objective interpretation of crystallographic diffraction data by means of the construction or completion of macromolecular models. Automated methods have rapidly gained in popularity as they are easy to use and generate reproducible and consistent results. However, the process of model building has become increasingly hidden and the user is often left to decide on how to proceed further with little feedback on what has preceded the output of the built model. Here, ArpNavigator, a molecular viewer tightly integrated into the ARP/wARP automated model-building package, is presented that directly controls model building and displays the evolving output in real time in order to make the procedure transparent to the user.
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spelling pubmed-36060412013-05-10 Visual automated macromolecular model building Langer, Gerrit G. Hazledine, Saul Wiegels, Tim Carolan, Ciaran Lamzin, Victor S. Acta Crystallogr D Biol Crystallogr Research Papers Automated model-building software aims at the objective interpretation of crystallographic diffraction data by means of the construction or completion of macromolecular models. Automated methods have rapidly gained in popularity as they are easy to use and generate reproducible and consistent results. However, the process of model building has become increasingly hidden and the user is often left to decide on how to proceed further with little feedback on what has preceded the output of the built model. Here, ArpNavigator, a molecular viewer tightly integrated into the ARP/wARP automated model-building package, is presented that directly controls model building and displays the evolving output in real time in order to make the procedure transparent to the user. International Union of Crystallography 2013-04-01 2013-03-14 /pmc/articles/PMC3606041/ /pubmed/23519672 http://dx.doi.org/10.1107/S0907444913000565 Text en © Langer et al. 2013 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
Langer, Gerrit G.
Hazledine, Saul
Wiegels, Tim
Carolan, Ciaran
Lamzin, Victor S.
Visual automated macromolecular model building
title Visual automated macromolecular model building
title_full Visual automated macromolecular model building
title_fullStr Visual automated macromolecular model building
title_full_unstemmed Visual automated macromolecular model building
title_short Visual automated macromolecular model building
title_sort visual automated macromolecular model building
topic Research Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3606041/
https://www.ncbi.nlm.nih.gov/pubmed/23519672
http://dx.doi.org/10.1107/S0907444913000565
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