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 synthetic polypeptides. I. The transform of atoms on a helix. (1952). Acta Cryst. 5, 581-586.
The observation by electron diffraction of a `superlattice' in annealed nickel single crystal films. (1963). Acta Cryst. 16, 54-57.
The structure of sodium thymonucleate fibres. II. The cylindrically symmetrical Patterson function. (1953). Acta Cryst. 6, 678-685.
The scattering of electrons by atoms and crystals. I. A new theoretical approach. (1957). Acta Cryst. 10, 609-619.
Complex alloy structures regarded as sphere packings. I. Definitions and basic principles. (1958). Acta Cryst. 11, 184-190.
Line profiles of neutron powder-diffraction peaks for structure refinement. (1967). Acta Cryst. 22, 151-152.
Crystallographic data for certain alkaloids. I. Some cinchona alkaloids; correction. (1952). Acta Cryst. 5, 554.
Electron density and thermal motion of diamond at elevated temperatures. (2023). Acta Cryst. A79, 41-50.
Instrumental broadening and the radial pair distribution function with 2D detectors. (2024). Acta Cryst. A80, 358-366.
A phase retrieval algorithm for triply periodic minimal surface like structures. (2023). Acta Cryst. A79, 51-58.
Universal simulation of absorption effects for X-ray diffraction in reflection geometry. (2024). Acta Cryst. A80, 315-328.
Crystallography of homophase twisted bilayers: coincidence, union lattices and space groups. (2023). Acta Cryst. A79, 301-317.
Bond topology of chain, ribbon and tube silicates. Part II. Geometrical analysis of infinite 1D arrangements of (TO4)n− tetrahedra. (2024). Acta Cryst. A80, 258-281.
The single-atom R1: a new optimization method to solve crystal structures. (2024). Acta Cryst. A80, 237-248.
ClusterFinder: a fast tool to find cluster structures from pair distribution function data. (2024). Acta Cryst. A80, 213-220.
GraphT–T (V1.0Beta), a program for embedding and visualizing periodic graphs in 3D Euclidean space. (2024). Acta Cryst. A80, 282-292.
Permissible domain walls in monoclinic ferroelectrics. Part II. The case of MC phases. (2024). Acta Cryst. A80, 293-304.
Machine learning for classifying narrow-beam electron diffraction data. (2023). Acta Cryst. A79, 360-368.
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The seventh blind test of crystal structure prediction: structure generation methods. (2024). Acta Cryst. B80, https://doi.org/10.1107/S2052520624007492.
The seventh blind test of crystal structure prediction: structure ranking methods. (2024). Acta Cryst. B80, https://doi.org/10.1107/S2052520624008679.
New ion radii for oxides and oxysalts, fluorides, chlorides and nitrides. (2024). Acta Cryst. B80, 326-339.
Crystal structures of two new high-pressure oxynitrides with composition SnGe4N4O4, from single-crystal electron diffraction. (2024). Acta Cryst. B80, 182-192.
Design of a series of cocrystals featuring isoniazid modified with diacetone alcohol. (2022). Acta Cryst. B78, 857-867.
Crystal structure solution and high-temperature thermal expansion in NaZr2(PO4)3-type materials. (2024). Acta Cryst. B80, 146-159.
Supramolecular synthons in hydrates and solvates of lamotrigine: a tool for cocrystal design. (2024). Acta Cryst. B80, 193-200.
Supramolecular architectures in multicomponent crystals of imidazole-based drugs and trithiocyanuric acid. (2024). Acta Cryst. B80, 294-304.
Ring formation of transition metal trichalcogenide TaSe3 using vapor liquid process. (2024). Acta Cryst. B80, 305-310.
Following the guidelines for communicating commensurate magnetic structures: real case examples. (2024). Acta Cryst. B80, 235-248.
A short note on the use of irreducible representations for tilted octahedra in perovskites. (2024). Acta Cryst. B80, 362-363.
Importance of powder diffraction raw data archival in a curated database for materials science applications. (2024). Acta Cryst. B80, 364-369.
New insights into the magnetism and magnetic structure of LuCrO3 perovskite. (2024). Acta Cryst. B80, 377-384.
Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers. (2024). Acta Cryst. C80, 239-253.
Relationship between synthesis method–crystal structure–melting properties in cocrystals: the case of caffeine–citric acid. (2024). Acta Cryst. C80, 221-229.
Absolute structure determination of Berkecoumarin by X-ray and electron diffraction. (2024). Acta Cryst. C80, 143-147.
Molecular structure and selective theophylline complexation by conformational change of diethyl N,N′-(1,3-phenylene)dicarbamate. (2024). Acta Cryst. C80, 190-199.
On the importance of crystal structures for organic thin film transistors. (2024). Acta Cryst. C80, 601-611.
Halogen bonds, chalcogen bonds, pnictogen bonds, tetrel bonds and other σ-hole interactions: a snapshot of current progress. (2023). Acta Cryst. C79, 204-216.
TAAM refinement on high-resolution experimental and simulated 3D ED/MicroED data for organic molecules. (2024). Acta Cryst. C80, 264-277.
Chalcogen bonding in the solid-state structures of 1,3-bis(benzimidazoliumyl)benzene-based chalcogen-bonding donors. (2023). Acta Cryst. C79, 26-35.
A snapshot love story: what serial crystallography has done and will do for us. (2024). Acta Cryst. D80, 563-579.
Factors affecting macromolecule orientations in thin films formed in cryo-EM. (2024). Acta Cryst. D80, 535-550.
Identifying and avoiding radiation damage in macromolecular crystallography. (2024). Acta Cryst. D80, 314-327.
The CCP4 suite: integrative software for macromolecular crystallography. (2023). Acta Cryst. D79, 449-461.
Cryo2RT: a high-throughput method for room-temperature macromolecular crystallography from cryo-cooled crystals. (2024). Acta Cryst. D80, 620-628.
A structural role for tryptophan in proteins, and the ubiquitous Trp Cδ1—HO=C (backbone) hydrogen bond. (2024). Acta Cryst. D80, 551-562.
STOPGAP: an open-source package for template matching, subtomogram alignment and classification. (2024). Acta Cryst. D80, 336-349.
High-confidence placement of low-occupancy fragments into electron density using the anomalous signal of sulfur and halogen atoms. (2024). Acta Cryst. D80, 451-463.
Likelihood-based interactive local docking into cryo-EM maps in ChimeraX. (2024). Acta Cryst. D80, 588-598.
Introduction of the Capsules environment to support further growth of the SBGrid structural biology software collection. (2024). Acta Cryst. D80, 439-450.
A database overview of metal-coordination distances in metalloproteins. (2024). Acta Cryst. D80, 362-376.
Tomo Live: an on-the-fly reconstruction pipeline to judge data quality for cryo-electron tomography workflows. (2024). Acta Cryst. D80, 247-258.
Pillar data-acquisition strategies for cryo-electron tomography of beam-sensitive biological samples. (2024). Acta Cryst. D80, 421-438.
Dimeric ethyltin(IV)–dibromide–hydroxide–N,N-dimethylformamide. (2024). Acta Cryst. E80, 522-526.
Synthesis and crystal structures of two racemic 2-heteroaryl-3-phenyl-2,3-dihydro-4H-pyrido[3,2-e][1,3]thiazin-4-ones. (2024). Acta Cryst. E80, 699-703.
Synthesis and crystallographic characterization of 6-hydroxy-1,2-dihydropyridin-2-one. (2023). Acta Cryst. E79, 1147-1150.
Structural characterization and comparative analysis of polymorphic forms of psilocin (4-hydroxy-N,N-dimethyltryptamine). (2024). Acta Cryst. E80, 590-595.
Electron crystallography and dedicated electron-diffraction instrumentation. (2023). Acta Cryst. E79, 410-422.
Crystal structures of the isomeric dipeptides L-glycyl-L-methionine and L-methionyl-L-glycine. (2024). Acta Cryst. E80, 725-728.
Crystal structure of polymeric bis(3-amino-1H-pyrazole)cadmium diiodide. (2024). Acta Cryst. E80, 816-819.
Synthesis and crystal structure of (2E)-1-[3,5-bis(benzyloxy)phenyl]-3-(4-ethoxyphenyl)prop-2-en-1-one. (2024). Acta Cryst. E80, 913-915.
Crystal structures of four thioglycosides involving carbamimidothioate groups. (2024). Acta Cryst. E80, 829-839.
Preparing research samples for safe arrival at centers and facilities: recipes for successful experiments. (2024). Acta Cryst. F80, 165-172.
X-ray crystal structure of a designed rigidified imaging scaffold in the ligand-free conformation. (2024). Acta Cryst. F80, 107-115.
Glucose-6-phosphate dehydrogenase and its 3D structures from crystallography and electron cryo-microscopy. (2024). Acta Cryst. F80, 236-251.
Ternary structure of Plasmodium vivax N-myristoyltransferase with myristoyl-CoA and inhibitor IMP-0001173. (2024). Acta Cryst. F80, 269-277.
Structural and biochemical characterization of the M405S variant of Desulfovibrio vulgaris formate dehydrogenase. (2024). Acta Cryst. F80, 98-106.
Room-temperature serial synchrotron crystallography structure of Spinacia oleracea RuBisCO. (2024). Acta Cryst. F80, 117-124.
Room-temperature serial synchrotron crystallography of the human phosphatase PTP1B. (2023). Acta Cryst. F79, 23-30.
The impact of exchanging the light and heavy chains on the structures of bovine ultralong antibodies. (2024). Acta Cryst. F80, 154-163.
Crystallographic fragment screen of the c-di-AMP-synthesizing enzyme CdaA from Bacillus subtilis. (2024). Acta Cryst. F80, 200-209.
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Crystal structure of human peptidylarginine deiminase type VI (PAD6) provides insights into its inactivity. (2024). IUCrJ 11, 395-404.
The evolution of raw data archiving and the growth of its importance in crystallography. (2024). IUCrJ 11, 464-475.
Crossing length scales: X-ray approaches to studying the structure of biological materials. (2024). IUCrJ 11, 708-722.
Refinement of cryo-EM 3D maps with a self-supervised denoising model: crefDenoiser. (2024). IUCrJ 11, 821-830.
Solvent organization in the ultrahigh-resolution crystal structure of crambin at room temperature. (2024). IUCrJ 11, 649-663.
Analysis of COF-300 synthesis: probing degradation processes and 3D electron diffraction structure. (2024). IUCrJ 11, 510-518.
Structure of Aquifex aeolicus lumazine synthase by cryo-electron microscopy to 1.42 Å resolution. (2024). IUCrJ 11, 723-729.
In situ serial crystallography facilitates 96-well plate structural analysis at low symmetry. (2024). IUCrJ 11, 780-791.
Free tools for crystallographic symmetry handling and visualization. (2024). J. Appl. Cryst. 57, 1618-1639.
Characterization of sub-micrometre-sized voids in fixed human brain tissue using scanning X-ray microdiffraction. (2024). J. Appl. Cryst. 57, 1528-1538.
A simple protocol for determining the zone axis direction from selected-area electron diffraction spot patterns of cubic materials. (2024). J. Appl. Cryst. 57, 1263-1269.
Mix and measure II: joint high-energy laboratory powder diffraction and microtomography for cement hydration studies. (2024). J. Appl. Cryst. 57, 1067-1084.
The human factor: results of a small-angle scattering data analysis round robin. (2023). J. Appl. Cryst. 56, 1618-1629.
Tripling of the scattering vector range of X-ray reflectivity on liquid surfaces using a double-crystal deflector. (2024). J. Appl. Cryst. 57, 258-265.
From solution to structure: empowering inclusive cryo-EM with a pre-characterization pipeline for biological samples. (2024). J. Appl. Cryst. 57, 602-605.
Flow-Xl: a new facility for the analysis of crystallization in flow systems. (2024). J. Appl. Cryst. 57, 1299-1310.
Revealing nanoscale sorption mechanisms of gases in a highly porous silica aerogel. (2024). J. Appl. Cryst. 57, 1311-1322.
Revisiting the structures and phase transitions of Ba2NaNb5O15. (2023). J. Appl. Cryst. 56, 1456-1465.
Neural networks for rapid phase quantification of cultural heritage X-ray powder diffraction data. (2024). J. Appl. Cryst. 57, 831-841.
Accessing self-diffusion on nanosecond time and nanometre length scales with minute kinetic resolution. (2024). J. Appl. Cryst. 57, 912-924.
Specimen-displacement correction for powder X-ray diffraction in Debye–Scherrer geometry with a flat area detector. (2023). J. Appl. Cryst. 56, 160-166.
BioXTAS RAW 2: new developments for a free open-source program for small-angle scattering data reduction and analysis. (2024). J. Appl. Cryst. 57, 194-208.
RefXAS: an open access database of X-ray absorption spectra. (2024). J. Synchrotron Rad. 31, 1105-1117.
The effect of transport apertures on relay-imaged, sharp-edged laser profiles in photoinjectors and the impact on electron beam properties. (2024). J. Synchrotron Rad. 31, 723-732.
Ion beam figuring for X-ray mirrors: history, state-of-the-art and future prospects. (2024). J. Synchrotron Rad. 31, 655-669.
PINK: a tender X-ray beamline for X-ray emission spectroscopy. (2024). J. Synchrotron Rad. 31, 622-634.
New opportunities for time-resolved imaging using diffraction-limited storage rings. (2024). J. Synchrotron Rad. 31, 1299-1307.
Diamond sensors for hard X-ray energy and position resolving measurements at the European XFEL. (2024). J. Synchrotron Rad. 31, 1029-1036.
Mapping of lithium ion concentrations in 3D structures through development of in situ correlative imaging of X-ray Compton scattering-computed tomography. (2024). J. Synchrotron Rad. 31, 888-895.
A sub-100 nm thickness flat jet for extreme ultraviolet to soft X-ray absorption spectroscopy. (2024). J. Synchrotron Rad. 31, 605-612.
BEATS: BEAmline for synchrotron X-ray microTomography at SESAME. (2024). J. Synchrotron Rad. 31, 1358-1372.
Revealing the structure of the active sites for the electrocatalytic CO2 reduction to CO over Co single atom catalysts using operando XANES and machine learning. (2024). J. Synchrotron Rad. 31, 741-750.
Opportunities and new developments for the study of surfaces and interfaces in soft condensed matter at the SIRIUS beamline of Synchrotron SOLEIL. (2024). J. Synchrotron Rad. 31, 162-176.
Demonstration of full polarization control of soft X-ray pulses with Apple X undulators at SwissFEL using recoil ion momentum spectroscopy. (2024). J. Synchrotron Rad. 31, 1134-1145.
In situ photodeposition of ultra-small palladium particles on TiO2. (2024). J. Synchrotron Rad. 31, 1071-1077.
ID22 – the high-resolution powder-diffraction beamline at ESRF. (2023). J. Synchrotron Rad. 30, 1003-1012.
Bis(diisobutylammonium) tetrachloridobis[3-(trifluoromethyl)phenyl]stannate. (2023). IUCrData 8, x230913.
Poly[3-methylpyridinium [(μ2-dihydrogen phosphito)bis(μ3-hydrogen phosphito)dizinc]]. (2024). IUCrData 9, x240345.
[1-(Anthracen-9-ylmethyl)-1,4,7,10-tetraazacyclododecane]chloridozinc(II) nitrate. (2024). IUCrData 9, x240665.
4-Fluorobenzyl (Z)-2-(2-oxoindolin-3-ylidene)hydrazine-1-carbodithioate. (2024). IUCrData 9, x240235.
Dicarbonyl-1κ2C-μ-chlorido-2:3κ2Cl:Cl-pentachlorido-2κ2Cl,3κ3Cl-[1(η6)-toluene]digallium(III)ruthenium(I)(Ru—Ga). (2024). IUCrData 9, x240657.
Chlorido[5,10,15,20-tetrakis(quinoline-7-carboxamido)porphinato]iron(III). (2024). IUCrData 9, x240496.
Bis(8-hydroxyquinolinium) naphthalene-1,5-disulfonate tetrahydrate. (2024). IUCrData 9, x240570.
Poly[[μ3-2-(benzotriazol-1-yl)acetato-κ3O:O′:N3]chlorido(ethanol-κO)cobalt(II)]. (2024). IUCrData 9, x240630.
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