An account is given of the development of the SHELX system of computer programs from SHELX-76 to the present day. In addition to identifying useful innovations that have come into general use through their implementation in SHELX, a critical analysis is presented of the less-successful features, missed opportunities and desirable improvements for future releases of…
Acta Crystallographica Section A Foundations of Crystallography Template
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About the Acta Crystallographica Section A Foundations of Crystallography format
Acta Crystallographica Section A Foundations of Crystallography is a peer-reviewed journal published by Wiley, covering X-ray Diffraction in Crystallography, Enzyme Structure and Function, Crystallization and Solubility Studies.
| Publisher | Wiley |
|---|---|
| Reference style | Author–year (Chicago) Author–year — (Smith, 2023) in the text Smith, Ada, Ben Jones, and Cara Lee. 2023. "A Representative Article Title." Acta Crystallographica Section A Foundations of Crystallography 12 (3): 45–58.
Formats any DOI in Acta Crystallographica Section A Foundations of Crystallography style. No sign-up. |
| Publishes research in | X-ray Diffraction in Crystallography Enzyme Structure and Function Crystallization and Solubility Studies Solid-state spectroscopy and crystallography Crystallography and molecular interactions |
| ISSN | 0108-7673 |
| h-index | 136 |
| i10-index | 1,891 |
| Total citations | 262,046 |
| Top institutions publishing here | Centre National de la Recherche Scientifique |
| You get | A submission-ready PDF and the editable LaTeX source — ready to submit. |
Papers published in Acta Crystallographica Section A Foundations of Crystallography per year
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Most-cited papers in Acta Crystallographica Section A Foundations of Crystallography
A number of extensions to the multisolution approach to the crystallographic phase problem are discussed in which the negative quartet relations play an important role. A phase annealing method, related to the simulated annealing approach in other optimization problems, is proposed and it is shown that it can result in an improvement of up to…
Map interpretation remains a critical step in solving the structure of a macromolecule. Errors introduced at this early stage may persist throughout crystallographic refinement and result in an incorrect structure. The normally quoted crystallographic residual is often a poor description for the quality of the model. Strategies and tools are described that help to alleviate…
The behaviour of Rogers's η parameter for enantiomorph-polarity estimation is examined theoretically and experimentally on simulated intensity data for seven well-assorted compounds. An alternative parameter x, based on incoherent scattering from twin components related by a centre of symmetry, is also considered. It is found that both parameters are very well adapted to implementation in…
A least-squares procedure is described for modeling an empirical transmission surface as sampled by multiple symmetry-equivalent and/or azimuth rotation-equivalent intensity measurements. The fitting functions are sums of real spherical harmonic functions of even order, ylm(-u0) + ylm(u1), 2 < or = l = 2n < or = 8. The arguments of the functions are the…