A Retrospective on the Development of Methods for the Analysis of Protein Conformational Ensembles
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2023
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oai:localhost:PNK-81932023-04-21T03:22:01Z A Retrospective on the Development of Methods for the Analysis of Protein Conformational Ensembles Steven, Hayward molecular dynamics Coarse-graining methods CC BY Analysing protein conformational ensembles whether from molecular dynamics (MD) simulation or other sources for functionally relevant conformational changes can be very challenging. In the nineteen nineties dimensional reduction methods were developed primarily for analysing MD trajectories to determine dominant motions with the aim of understanding their relationship to function. Coarse-graining methods were also developed so the conformational change between two structures could be described in terms of the relative motion of a small number of quasi-rigid regions rather than in terms of a large number of atoms. 2023-04-21T03:22:01Z 2023-04-21T03:22:01Z 2023 Book https://link.springer.com/article/10.1007/s10930-023-10113-9 https://dlib.phenikaa-uni.edu.vn/handle/PNK/8193 en application/pdf Springer |
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Digital Phenikaa |
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Digital Phenikaa |
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English |
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molecular dynamics Coarse-graining methods |
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molecular dynamics Coarse-graining methods Steven, Hayward A Retrospective on the Development of Methods for the Analysis of Protein Conformational Ensembles |
description |
CC BY |
format |
Book |
author |
Steven, Hayward |
author_facet |
Steven, Hayward |
author_sort |
Steven, Hayward |
title |
A Retrospective on the Development of Methods for the Analysis of Protein Conformational Ensembles |
title_short |
A Retrospective on the Development of Methods for the Analysis of Protein Conformational Ensembles |
title_full |
A Retrospective on the Development of Methods for the Analysis of Protein Conformational Ensembles |
title_fullStr |
A Retrospective on the Development of Methods for the Analysis of Protein Conformational Ensembles |
title_full_unstemmed |
A Retrospective on the Development of Methods for the Analysis of Protein Conformational Ensembles |
title_sort |
retrospective on the development of methods for the analysis of protein conformational ensembles |
publisher |
Springer |
publishDate |
2023 |
url |
https://link.springer.com/article/10.1007/s10930-023-10113-9 https://dlib.phenikaa-uni.edu.vn/handle/PNK/8193 |
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1763815058799853568 |
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8.891053 |