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J. Appl. Cryst.の発刊に際して

良二 上田
- Vol. 12, Iss: 1, pp 1-1
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The article was published on 1970-03-10 and is currently open access. It has received 8159 citations till now.

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A short history of SHELX

TL;DR: This paper could serve as a general literature citation when one or more of the open-source SH ELX programs (and the Bruker AXS version SHELXTL) are employed in the course of a crystal-structure determination.
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The Protein Data Bank

TL;DR: The goals of the PDB are described, the systems in place for data deposition and access, how to obtain further information and plans for the future development of the resource are described.
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Crystal structure refinement with SHELXL

TL;DR: New features added to the refinement program SHELXL since 2008 are described and explained.
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Coot: model-building tools for molecular graphics.

TL;DR: CCP4mg is a project that aims to provide a general-purpose tool for structural biologists, providing tools for X-ray structure solution, structure comparison and analysis, and publication-quality graphics.
References
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Automated matching of high‐ and low‐resolution structural models

TL;DR: A normalized spatial discrepancy (NSD) is introduced as a proximity measure between three-dimensional objects so as to provide a quantitative estimate of similarity between the objects.
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An introduction to data reduction: space-group determination, scaling and intensity statistics.

TL;DR: A summary of how to run the data-reduction programs in the CCP4 suite.
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Parallel tempering: Theory, applications, and new perspectives

TL;DR: A selected set of the many applications that have become possible with the introduction of parallel tempering are mentioned, and several promising avenues for future research are suggested.
Journal ArticleDOI

Data processing and analysis with the autoPROC toolbox

TL;DR: Typical topics and problems encountered during data processing of diffraction experiments are discussed and the tools provided in the autoPROC software are described.
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Iterative model-building, structure refinement, and density modification with the PHENIX AutoBuild Wizard

TL;DR: The highly automated PHENIX AutoBuild wizard is described, which can be applied equally well to phases derived from isomorphous/anomalous and molecular-replacement methods.