most read articles
These are the most read articles in the last six months.
The structure of sodium thymonucleate fibres. I. The influence of water content. (1953). Acta Cryst. 6, 673-677.
The structure of sodium thymonucleate fibres. II. The cylindrically symmetrical Patterson function. (1953). Acta Cryst. 6, 678-685.
Polymorphism in potassium niobate, sodium niobate, and other ABO3 compounds. (1951). Acta Cryst. 4, 353-362.
The scattering of electrons by atoms and crystals. I. A new theoretical approach. (1957). Acta Cryst. 10, 609-619.
Line profiles of neutron powder-diffraction peaks for structure refinement. (1967). Acta Cryst. 22, 151-152.
Angle calculations for 3- and 4-circle X-ray and neutron diffractometers. (1967). Acta Cryst. 22, 457-464.
Complex alloy structures regarded as sphere packings. I. Definitions and basic principles. (1958). Acta Cryst. 11, 184-190.
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Identification of a coherent twin relationship from high-resolution reciprocal-space maps. (2022). Acta Cryst. A78, 158-171.
Ab initio reconstruction from one-dimensional crystal diffraction data. (2022). Acta Cryst. A78, 249-261.
Correlation between two- and three-dimensional crystallographic lattices for epitaxial analysis. II. Experimental results. (2022). Acta Cryst. A78, 272-282.
Correlation between two- and three-dimensional crystallographic lattices for epitaxial analysis. I. Theory. (2022). Acta Cryst. A78, 262-271.
Irreducible and site-symmetry-induced representations of single/double ordinary/grey layer groups. (2022). Acta Cryst. A78, 107-114.
A cloud platform for atomic pair distribution function analysis: PDFitc. (2021). Acta Cryst. A77, 2-6.
Combining X-rays, neutrons and electrons, and NMR, for precision and accuracy in structure–function studies. (2021). Acta Cryst. A77, 173-185.
Macromolecular phasing using diffraction from multiple crystal forms. (2021). Acta Cryst. A77, 19-35.
Layer groups: Brillouin-zone and crystallographic databases on the Bilbao Crystallographic Server. (2021). Acta Cryst. A77, 559-571.
Comparison of the temperature- and pressure-dependent behavior of the crystal structure of CrAs. (2021). Acta Cryst. B77, 594-604.
Phase transitions and (p–T–X) behaviour of centrosymmetric perovskites: modelling with transformed crystallographic data. (2022). Acta Cryst. B78, 40-60.
Circumventing a challenging aspect of crystal structure determination from powder diffraction data. (2022). Acta Cryst. B78, 96-99.
π-Hole bonding in a new co-crystal hydrate of gallic acid and pyrazine: static and dynamic charge density analysis. (2022). Acta Cryst. B78, 231-246.
A four-dimensional model for the Ba–Ti–O dodecagonal quasicrystal. (2022). Acta Cryst. B78, 247-252.
Effect of synchrotron X-ray radiation damage on phase transitions in coordination polymers at high pressure. (2022). Acta Cryst. B78, 100-106.
A novel energetic cocrystal composed of CL-20 and 1-methyl-2,4,5-trinitroimidazole with high energy and low sensitivity. (2022). Acta Cryst. B78, 133-139.
Interplay of thermal diffuse scattering and correlated compositional disorder in KCl1–xBrx. (2022). Acta Cryst. B78, 385-391.
Structure correlation and dynamics in crystals – a tribute to Hans-Beat Bürgi. (2022). Acta Cryst. B78, 281-282.
ChemEnv: a fast and robust coordination environment identification tool. (2020). Acta Cryst. B76, 683-695.
Psilocybin: crystal structure solutions enable phase analysis of prior art and recently patented examples. (2022). Acta Cryst. C78, 36-55.
8-Furylimidazolo-2′-deoxycytidine: crystal structure, packing, atropisomerism and fluorescence. (2022). Acta Cryst. C78, 141-147.
Coordination chemistry of nitrile-functionalized mixed thia-aza macrocycles [9]aneN2S and [9]aneNS2 towards silver(I). (2022). Acta Cryst. C78, 169-175.
Synthesis and structure of two isomers of a molybdenum(II) 2-butyne complex stabilized by bioinspired S,N-bidentate ligands. (2022). Acta Cryst. C78, 218-222.
Investigating pair distribution function use in analysis of nanocrystalline hydroxyapatite and carbonate-substituted hydroxyapatite. (2022). Acta Cryst. C78, 271-279.
Comment on molybdenum polyoxo clusters: from the `Blues' to the `Reds'. (2022). Acta Cryst. C78, 322-323.
Weaving a 2D net of hydrogen and halogen bonds: cocrystal of a pyrazolium bromide with tetrafluorodiiodobenzene. (2022). Acta Cryst. C78, 324-331.
Crystal structures of three β-halolactic acids: hydrogen bonding resulting in differing Z′. (2022). Acta Cryst. C78, 257-264.
Crystal and molecular structures of fac-[Re(Bid)(PPh3)(CO)3] [Bid is tropolone (TropH) and tribromotropolone (TropBr3H)]. (2022). Acta Cryst. C78, 351-359.
Deep hydration of an Li7–3xLa3Zr2MIIIxO12 solid-state electrolyte material: a case study on Al- and Ga-stabilized LLZO. (2022). Acta Cryst. C78, 1-6.
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Protein structure prediction by AlphaFold2: are attention and symmetries all you need?. (2021). Acta Cryst. D77, 982-991.
Implications of AlphaFold2 for crystallographic phasing by molecular replacement. (2022). Acta Cryst. D78, 1-13.
Determining the oxidation state of elements by X-ray crystallography. (2022). Acta Cryst. D78, 238-247.
How do I get the most out of my protein sequence using bioinformatics tools?. (2021). Acta Cryst. D77, 1116-1126.
Fast fragment- and compound-screening pipeline at the Swiss Light Source. (2022). Acta Cryst. D78, 328-336.
Structural snapshot of a glycoside hydrolase family 8 endo-β-1,4-glucanase capturing the state after cleavage of the scissile bond. (2022). Acta Cryst. D78, 228-237.
Detecting ice artefacts in processed macromolecular diffraction data with machine learning. (2022). Acta Cryst. D78, 187-195.
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Crystal structures of two dioxomolybdenum complexes stabilized by salan ligands featuring phenyl and cyclohexyl backbones. (2022). Acta Cryst. E78, 244-250.
Chlorocobalt complexes with pyridylethyl-derived diazacycloalkanes. (2022). Acta Cryst. E78, 235-243.
Ciprofloxacin salt and salt co-crystal with dihydroxybenzoic acids. (2022). Acta Cryst. E78, 259-263.
Crystal structures of 3-halo-2-organochalcogenylbenzo[b]chalcogenophenes. (2022). Acta Cryst. E78, 275-281.
Crystal structures of two Co(NCS)2 urotropine coordination compounds with different Co coordinations. (2022). Acta Cryst. E78, 264-269.
Crystal structure of tris(4,7-diphenyl-1,10-phenanthroline-κ2N,N′)cobalt(III) tris(hexafluorophosphate) monohydrate. (2022). Acta Cryst. E78, 313-316.
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Crystal structure of betaine aldehyde dehydrogenase from Burkholderia pseudomallei. (2022). Acta Cryst. F78, 45-51.
A crystal-processing machine using a deep-ultraviolet laser: application to long-wavelength native SAD experiments. (2022). Acta Cryst. F78, 88-95.
Crystal structure of a short-chain dehydrogenase/reductase from Burkholderia phymatum in complex with NAD. (2022). Acta Cryst. F78, 52-58.
Crystal structure of an inorganic pyrophosphatase from Chlamydia trachomatis D/UW-3/Cx. (2022). Acta Cryst. F78, 135-142.
Conformational flexibility in the zinc solute-binding protein ZnuA. (2022). Acta Cryst. F78, 128-134.
Crystal structure of a hypothetical protein from Giardia lamblia. Corrigendum. (2022). Acta Cryst. F78, 143.
Crystal structure of the kringle domain of human receptor tyrosine kinase-like orphan receptor 1 (hROR1). (2022). Acta Cryst. F78, 185-192.
Expression, purification and crystallization of a novel metagenome-derived salicylaldehyde dehydrogenase from Alpine soil. (2022). Acta Cryst. F78, 161-169.
In situ crystal data-collection and ligand-screening system at SPring-8. (2022). Acta Cryst. F78, 241-251.
Biochemical and crystallization analysis of the CENP-SX–DNA complex. (2022). Acta Cryst. F78, 193-199.
The structure of Synechococcus elongatus enolase reveals key aspects of phosphoenolpyruvate binding. (2022). Acta Cryst. F78, 177-184.
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Preferred orientation and its effects on intensity-correlation measurements. (2022). IUCrJ 9, 231-242.
Negative linear compressibility in Se at ultra-high pressure above 120 GPa. (2022). IUCrJ 9, 253-260.
Trends in coordination of rhenium organometallic complexes in the Protein Data Bank. (2022). IUCrJ 9, 180-193.
High-resolution single-particle cryo-EM of samples vitrified in boiling nitrogen. (2021). IUCrJ 8, 867-877.
CrystalExplorer: a program for Hirshfeld surface analysis, visualization and quantitative analysis of molecular crystals. (2021). J. Appl. Cryst. 54, 1006-1011.
The advanced treatment of hydrogen bonding in quantum crystallography. (2021). J. Appl. Cryst. 54, 718-729.
Grazing-incidence X-ray diffraction investigation of the coincidence site lattice of the Ge/Si(001) system. (2020). J. Appl. Cryst. 53, 1212-1216.
The very small angle neutron scattering instrument at the National Institute of Standards and Technology. (2022). J. Appl. Cryst. 55, 271-283.
ATSAS 3.0: expanded functionality and new tools for small-angle scattering data analysis. (2021). J. Appl. Cryst. 54, 343-355.
A drug-discovery-oriented non-invasive protocol for protein crystal cryoprotection by dehydration, with application for crystallization screening. (2022). J. Appl. Cryst. 55, 370-379.
Efficient solution of particle shape functions for the analysis of powder total scattering data. (2022). J. Appl. Cryst. 55, 329-339.
Performance of the new biological small- and wide-angle X-ray scattering beamline 13A at the Taiwan Photon Source. (2022). J. Appl. Cryst. 55, 340-352.
Scipion-ED: a graphical user interface for batch processing and analysis of 3D ED/MicroED data. (2022). J. Appl. Cryst. 55, 638-646.
A new library of 3D models and problems for teaching crystallographic symmetry generated through Blender for use with 3D printers or Sketchfab. (2022). J. Appl. Cryst. 55, 172-179.
Parent grain reconstruction from partially or fully transformed microstructures in MTEX. (2022). J. Appl. Cryst. 55, 180-194.
Structure evolution of nanodiamond aggregates: a SANS and USANS study. (2022). J. Appl. Cryst. 55, 353-361.
3D printed devices and infrastructure for liquid sample delivery at the European XFEL. (2022). J. Synchrotron Rad. 29, 331-346.
A wide-field micro-computed tomography detector: micron resolution at half-centimetre scale. (2022). J. Synchrotron Rad. 29, 505-514.
ID23-2: an automated and high-performance microfocus beamline for macromolecular crystallography at the ESRF. (2022). J. Synchrotron Rad. 29, 581-590.
Effective coordination numbers from EXAFS: general approaches for lanthanide and actinide dioxides. (2022). J. Synchrotron Rad. 29, 288-294.
A cell design for correlative hard X-ray nanoprobe and electron microscopy studies of catalysts under in situ conditions. (2022). J. Synchrotron Rad. 29, 431-438.
High-speed free-run ptychography at the Australian Synchrotron. (2022). J. Synchrotron Rad. 29, 480-487.
Generating coherent and ultrashort X-ray pulses via HHG-seeding in storage rings. (2022). J. Synchrotron Rad. 29, 347-354.
Trapezoid-kinoform zone plate lens – a solution for efficient focusing in hard X-ray optics. (2022). J. Synchrotron Rad. 29, 386-392.
Fast and noise-tolerant determination of the center of rotation in tomography. (2022). J. Synchrotron Rad. 29, 488-495.
Implementation of wedged-serial protein crystallography at PROXIMA-1. (2022). J. Synchrotron Rad. 29, 439-446.
Operational status of the X-ray powder diffraction beamline at the SESAME synchrotron. (2022). J. Synchrotron Rad. 29, 532-539.
I21: an advanced high-resolution resonant inelastic X-ray scattering beamline at Diamond Light Source. (2022). J. Synchrotron Rad. 29, 563-580.
SAXS study of the formation and structure of polynuclear thorium(IV) colloids and thorium dioxide nanoparticles. (2022). J. Synchrotron Rad. 29, 281-287.
Visualizing the valence states of europium ions in Eu-doped BaAl2O4 using X-ray nanoprobe mapping. (2022). J. Synchrotron Rad. 29, 456-461.
From EXAFS of reference compounds to U(VI) speciation in contaminated environments. (2022). J. Synchrotron Rad. 29, 303-314.
Using diffraction losses of X-rays in a single crystal for determination of its lattice parameters as well as for monochromator calibration. (2022). J. Synchrotron Rad. 29, 369-376.
Bis[1,2-bis(4-chlorophenyl)ethylene-1,2-dithiolato(1–)]nickel(II). (2022). IUCrData 7, x220148.
Ethyl 10-cyano-7-hydroxy-6-oxo-3-phenyl-8,9,10,10a-tetrahydro-6H-benzo[c]chromene-10-carboxylate. (2022). IUCrData 7, x220199.
Bis(2-amino-3,5-dichloropyridinium) hexachloridostannate(IV) dihydrate. (2022). IUCrData 7, x220191.
1-(Methyl-α-D-glucopyranosid-6-yl)-3-vinylimidazolium iodide dimethylformamide monosolvate. (2022). IUCrData 7, x220265.
catena-Poly[oxidanium [tris{μ-[amino(iminio)methyl]phosphonato}zincate(II)]]. (2022). IUCrData 7, x220247.
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