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Using Situs for the integration of multi-resolution structures.

作者信息

Wriggers Willy

出版信息

Biophys Rev. 2010 Feb;2(1):21-27. doi: 10.1007/s12551-009-0026-3. Epub 2010 Jan 8.


DOI:10.1007/s12551-009-0026-3
PMID:20174447
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC2821521/
Abstract

Situs is a modular and widely used software package for the integration of biophysical data across the spatial resolution scales. It has been developed over the last decade with a focus on bridging the resolution gap between atomic structures, coarse-grained models, and volumetric data from low-resolution biophysical origins, such as electron microscopy, tomography, or small-angle scattering. Structural models can be created and refined with various flexible and rigid body docking strategies. The software consists of multiple, stand-alone programs for the format conversion, analysis, visualization, manipulation, and assembly of 3D data sets. The programs have been ported to numerous platforms in both serial and shared memory parallel architectures and can be combined in various ways for specific modeling applications. The modular design facilitates the updating of individual programs and the development of novel application workflows. This review provides an overview of the Situs package as it exists today with an emphasis on functionality and workflows supported by version 2.5. ELECTRONIC SUPPLEMENTARY MATERIAL: The online version of this article (doi:10.1007/s12551-009-0026-3) contains supplementary material, which is available to authorized users.

摘要
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/4336/5418375/fef99955b450/12551_2009_26_Fig6_HTML.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/4336/5418375/c7bf1cf9ab9a/12551_2009_26_Fig1_HTML.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/4336/5418375/cedbe17b9e7b/12551_2009_26_Fig2_HTML.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/4336/5418375/25061a3ed6eb/12551_2009_26_Fig3_HTML.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/4336/5418375/17cb6175f2f5/12551_2009_26_Fig4_HTML.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/4336/5418375/6e153e744626/12551_2009_26_Fig5_HTML.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/4336/5418375/fef99955b450/12551_2009_26_Fig6_HTML.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/4336/5418375/c7bf1cf9ab9a/12551_2009_26_Fig1_HTML.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/4336/5418375/cedbe17b9e7b/12551_2009_26_Fig2_HTML.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/4336/5418375/25061a3ed6eb/12551_2009_26_Fig3_HTML.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/4336/5418375/17cb6175f2f5/12551_2009_26_Fig4_HTML.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/4336/5418375/6e153e744626/12551_2009_26_Fig5_HTML.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/4336/5418375/fef99955b450/12551_2009_26_Fig6_HTML.jpg

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本文引用的文献

[1]
Discovery through the computational microscope.

Structure. 2009-10-14

[2]
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Nature. 2009-9-10

[3]
The structure of a biologically active influenza virus ribonucleoprotein complex.

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J Mol Biol. 2008-12-26

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