most read articles

These are the most read articles in the last six months.

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ACTA
CRYSTALLOGRAPHICA
The structure of sodium thymonucleate fibres. I. The influence of water content. R. E. Franklin & R. G. Gosling (1953). Acta Cryst. 6, 673-677. 
The packing of [alpha]-helices: simple coiled-coils. F. H. C. Crick (1953). Acta Cryst. 6, 689-697. 
The structure of sodium thymonucleate fibres. II. The cylindrically symmetrical Patterson function. R. E. Franklin & R. G. Gosling (1953). Acta Cryst. 6, 678-685. 
Peter Debye, 1884-1966. P. P. Ewald (1967). Acta Cryst. 22, 947-949. 
Max von Laue, 1879-1960. P. P. Ewald (1960). Acta Cryst. 13, 513-515. 
Arthur Lindo Patterson, 1902-1966. R. E. Marsh & D. P. Shoemaker (1967). Acta Cryst. 22, 749-750. 
The crystal structure of ferrocene. J. D. Dunitz, L. E. Orgel & A. Rich (1956). Acta Cryst. 9, 373-375. 
The crystal structure of zinc acetate dihydrate, Zn(CH3COO)2.2H2O. J. N. van Niekerk, F. R. L. Schoening & J. H. Talbot (1953). Acta Cryst. 6, 720-723. 
The Fourier transform of a coiled-coil. F. H. C. Crick (1953). Acta Cryst. 6, 685-689. 
The crystal structure of Bi and of solid solutions of Pb, Sn, Sb and Te in Bi. P. Cucka & C. S. Barrett (1962). Acta Cryst. 15, 865-872. 
Structure cristalline de l'indirubine. H. Pandraud (1961). Acta Cryst. 14, 901-908. 
The unit cell of potassium borohydride, KBH4, at 90° K. P. T. Ford & H. M. Powell (1954). Acta Cryst. 7, 604-605. 
The structure of graphitic carbons. R. E. Franklin (1951). Acta Cryst. 4, 253-261. 
The scattering of electrons by atoms and crystals. I. A new theoretical approach. J. M. Cowley & A. F. Moodie (1957). Acta Cryst. 10, 609-619. 
The form birefringence of macromolecules. W. L. Bragg & A. B. Pippard (1953). Acta Cryst. 6, 865-867. 
Complex alloy structures regarded as sphere packings. I. Definitions and basic principles. F. C. Frank & J. S. Kasper (1958). Acta Cryst. 11, 184-190. 
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FOUNDATIONS
ADVANCES
A cloud platform for atomic pair distribution function analysis: PDFitc. L. Yang, E. A. Culbertson, N. K. Thomas, H. T. Vuong, E. T. S. Kjær, K. M. Ø. Jensen, M. G. Tucker & S. J. L. Billinge (2021). Acta Cryst. A77, 2-6. 
Modern crystallography and its foundations. A. Altomare & S. J. L. Billinge (2021). Acta Cryst. A77, 1. 
Macromol­ecular phasing using diffraction from multiple crystal forms. M. Metz, R. D. Arnal, W. Brehm, H. N. Chapman, A. J. Morgan & R. P. Millane (2021). Acta Cryst. A77, 19-35. 
Quaternions: what are they, and why do we need to know?. B. K. P. Horn (2020). Acta Cryst. A76, 556-558. 
Multipole electron densities and structural parameters from synchrotron powder X-ray diffraction data obtained with a MYTHEN detector system (OHGI). B. Svane, K. Tolborg, K. Kato & B. B. Iversen (2021). Acta Cryst. A77, 85-95. 
The quaternion-based spatial-coordinate and orientation-frame alignment problems. A. J. Hanson (2020). Acta Cryst. A76, 432-457. 
Algorithms for target transformations of lattice basis vectors. S. Gorfman (2020). Acta Cryst. A76, 713-718. 
pinkIndexer – a universal indexer for pink-beam X-ray and electron diffraction snapshots. Y. Gevorkov, A. Barty, W. Brehm, T. A. White, A. Tolstikova, M. O. Wiedorn, A. Meents, R.-R. Grigat, H. N. Chapman & O. Yefanov (2020). Acta Cryst. A76, 121-131. 
The atomic structure of the Bergman-type icosahedral quasicrystal based on the Ammann–Kramer–Neri tiling. I. Buganski, J. Wolny & H. Takakura (2020). Acta Cryst. A76, 180-196. 
Experimentally obtained and computer-simulated X-ray non-coplanar 18-beam pinhole topographs for a silicon crystal. K. Okitsu, Y. Imai & Y. Yoda (2019). Acta Cryst. A75, 483-488. 
Structure-mining: screening structure models by automated fitting to the atomic pair distribution function over large numbers of models. L. Yang, P. Juhás, M. W. Terban, M. G. Tucker & S. J. L. Billinge (2020). Acta Cryst. A76, 395-409. 
Coordination sequences of crystals are of quasi-polynomial type. Y. Nakamura, R. Sakamoto, T. Mase & J. Nakagawa (2021). Acta Cryst. A77, 138-148. 
X-ray diffraction from strongly bent crystals and spectroscopy of X-ray free-electron laser pulses. V. M. Kaganer, I. Petrov & L. Samoylova (2020). Acta Cryst. A76, 55-69. 
Bayesian machine learning improves single-wavelength anomalous diffraction phasing. M.-J. Garcia-Bonete & G. Katona (2019). Acta Cryst. A75, 851-860. 
A flexible and standalone forward simulation model for laboratory X-ray diffraction contrast tomography. H. Fang, D. Juul Jensen & Y. Zhang (2020). Acta Cryst. A76, 652-663. 
XGANDALF – extended gradient descent algorithm for lattice finding. Y. Gevorkov, O. Yefanov, A. Barty, T. A. White, V. Mariani, W. Brehm, A. Tolstikova, R.-R. Grigat & H. N. Chapman (2019). Acta Cryst. A75, 694-704. 
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STRUCTURAL SCIENCE
CRYSTAL ENGINEERING
MATERIALS
Structure variations within RSi2 and R2TSi3 silicides. Part I. Structure overview. M. Nentwich, M. Zschornak, M. Sonntag, R. Gumeniuk, S. Gemming, T. Leisegang & D. C. Meyer (2020). Acta Cryst. B76, 177-200. 
Lab in a DAC – high-pressure crystal chemistry in a diamond-anvil cell. A. Katrusiak (2019). Acta Cryst. B75, 918-926. 
Pristine and hydrated fluoroapatite (0001). X. Torrelles, I. M. Nadeem, A. Kupka, A. Crespo-Villanueva, S. Meis, H. Gies & O. Bikondoa (2019). Acta Cryst. B75, 830-838. 
High-pressure preference for reduced water content in porous zinc aspartate hydrates. K. Roszak & A. Katrusiak (2020). Acta Cryst. B76, 795-801. 
Pressure-induced transformation of CH3NH3PbI3: the role of the noble-gas pressure transmitting media. A. Arakcheeva, V. Svitlyk, E. Polini, L. Henry, D. Chernyshov, A. Sienkiewicz, G. Giriat, A. Glushkova, M. Kollar, B. Náfrádi, L. Forro & E. Horváth (2019). Acta Cryst. B75, 361-370. 
Automated electron diffraction tomography – development and applications. U. Kolb, Y. Krysiak & S. Plana-Ruiz (2019). Acta Cryst. B75, 463-474. 
The influence of deuteration on the crystal structure of hybrid halide perovskites: a temperature-dependent neutron diffraction study of FAPbBr3. A. Franz, D. M. Többens, F. Lehmann, M. Kärgell & S. Schorr (2020). Acta Cryst. B76, 267-274. 
Synthesis, crystal structure and structure–property relations of strontium orthocarbonate, Sr2CO4. D. Laniel, J. Binck, B. Winkler, S. Vogel, T. Fedotenko, S. Chariton, V. Prakapenka, V. Milman, W. Schnick, L. Dubrovinsky & N. Dubrovinskaia (2021). Acta Cryst. B77, 131-137. 
Ca-doped rare earth perovskite materials for tailored exsolution of metal nanoparticles. L. Lindenthal, T. Ruh, R. Rameshan, H. Summerer, A. Nenning, C. Herzig, S. Löffler, A. Limbeck, A. K. Opitz, P. Blaha & C. Rameshan (2020). Acta Cryst. B76, 1055-1070. 
Inelastic scattering and solvent scattering reduce dynamical diffraction in biological crystals. T. Latychevskaia & J. P. Abrahams (2019). Acta Cryst. B75, 523-531. 
Cation distribution in Cu2ZnSnSe4, Cu2FeSnS4 and Cu2ZnSiSe4 by multiple-edge anomalous diffraction. D. M. Többens, G. Gurieva, S. Niedenzu, G. Schuck, I. Zizak & S. Schorr (2020). Acta Cryst. B76, 1027-1035. 
Polymorphism and surface diversity arising from stress-induced transformations – the case of multicomponent forms of carbamazepine. G. Schneider-Rauber, M. Arhangelskis, A. D. Bond, R. Ho, N. Nere, S. Bordawekar, A. Y. Sheikh & W. Jones (2021). Acta Cryst. B77, 54-67. 
Study on the structural phase transitions in NaSICON-type compounds using Ag3Sc2(PO4)3 as a model system. G. J. Redhammer, G. Tippelt, Q. Stahl, A. Benisek & D. Rettenwander (2021). Acta Cryst. B77, 10-22. 
C60 in a peptidic cage: a case of symmetry mismatch studied by crystallography and solid-state NMR. M. Gilski, P. Bernatowicz, A. Sakowicz, M. P. Szymański, A. Zalewska, A. Szumna & M. Jaskólski (2020). Acta Cryst. B76, 815-824. 
Single-crystal neutron and X-ray diffraction study of garnet-type solid-state electrolyte Li6La3ZrTaO12: an in situ temperature-dependence investigation (2.5 ≤ T ≤ 873 K). G. J. Redhammer, M. Meven, S. Ganschow, G. Tippelt & D. Rettenwander (2021). Acta Cryst. B77, 123-130. 
Nickel(II) com­plexes based on L-amino-acid-derived ligands: synthesis, characterization and study of the role of the supramolecular structure in carbon dioxide capture. A. Rivas Marquina, F. Movilla, O. C. Sánchez Montilva, E. Rentschler, L. Carrella, P. Albores & F. Di Salvo (2020). Acta Cryst. B76, 825-838. 
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STRUCTURAL
CHEMISTRY
Crystallization of metastable monoclinic carnallite, KCl·MgCl2·6H2O: missing structural link in the carnallite family. M. Pannach, I. Paschke, H. Schmidt, D. Freyer & W. Voigt (2020). Acta Cryst. C76, 507-512. 
First COVID-19 mol­ecular docking with a chalcone-based compound: synthesis, single-crystal structure and Hirshfeld surface analysis study. M. A. Alsafi, D. L. Hughes & M. A. Said (2020). Acta Cryst. C76, 1043-1050. 
Synthesis of N-substituted 3-(2-aryl-2-oxoeth­yl)-3-hy­droxy­indolin-2-ones and their conversion to N-substituted (E)-3-(2-aryl-2-oxo­ethyl­idene)indolin-2-ones: synthetic sequence, spectroscopic characterization and structures of four 3-hy­droxy com­pounds and five oxo­ethyl­idene products. D. Becerra, J. Castillo, B. Insuasty, J. Cobo & C. Glidewell (2020). Acta Cryst. C76, 433-445. 
Crystal structures of salts of bedaquiline. M. Okezue, D. Smith, M. Zeller, S. R. Byrn, P. Smith, S. Bogandowich-Knipp, D. K. Purcell & K. L. Clase (2020). Acta Cryst. C76, 1010-1023. 
A new hydrate of magnesium carbonate, MgCO3·6H2O. C. Rincke, H. Schmidt & W. Voigt (2020). Acta Cryst. C76, 244-249. 
Crystal structure of a calcium(II)–pyrrolo­quinoline quinone (PQQ) complex outside a protein environment. H. Lumpe, P. Mayer & L. J. Daumann (2020). Acta Cryst. C76, 1051-1056. 
There's many a good tune played on an old fiddle – a new colour for Alfred Werner's isomer counting. E. C. Constable (2020). Acta Cryst. C76, 312-313. 
(E)-4-Bromo-2-[(phenyl­imino)­meth­yl]phenol: a new poly­morph and thermochromism. H. E. Mason, J. A. K. Howard & H. A. Sparkes (2020). Acta Cryst. C76, 1001-1004. 
Improving the solubility of berberine. J. A. Fernandes (2020). Acta Cryst. C76, 117. 
Deciphering the hydrogen-bonding scheme in the crystal structure of tri­phenyl­methanol: a tribute to George Ferguson and co-workers. T. Rodríguez Tzompantzi, A. G. Amaro Hernández, R. L. Meza-León & S. Bernès (2019). Acta Cryst. C75, 1266-1273. 
The many flavours of halogen bonds – message from experimental electron density and Raman spectroscopy. R. Wang, J. George, S. K. Potts, M. Kremer, R. Dronskowski & U. Englert (2019). Acta Cryst. C75, 1190-1201. 
Regioselective synthesis and characterization of monovanadium-substituted β-octa­molybdate [VMo7O26]5−. L. Krivosudský, A. Roller & A. Rompel (2019). Acta Cryst. C75, 872-876. 
Phase transition and structures of the twinned low-temperature phases of (Et4N)[ReS4]. E. Bernhardt & R. Herbst-Irmer (2020). Acta Cryst. C76, 231-235. 
The decades-old mystery of bis­(diethyl ether)tungsten(IV) chloride solved. A. Schäfer (2021). Acta Cryst. C77, 167-168. 
Crystallographic curiosities: polymorphism and structures with Z′ > 1. W. Clegg (2019). Acta Cryst. C75, 833-834. 
Inter­molecular inter­actions and disorder in six isostructural cele­coxib solvates. A. D. Bond & C. C. Sun (2020). Acta Cryst. C76, 632-638. 
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BIOLOGICAL
CRYSTALLOGRAPHY
Macromolecular structure determination using X-rays, neutrons and electrons: recent developments in Phenix. D. Liebschner, P. V. Afonine, M. L. Baker, G. Bunkóczi, V. B. Chen, T. I. Croll, B. Hintze, L.-W. Hung, S. Jain, A. J. McCoy, N. W. Moriarty, R. D. Oeffner, B. K. Poon, M. G. Prisant, R. J. Read, J. S. Richardson, D. C. Richardson, M. D. Sammito, O. V. Sobolev, D. H. Stockwell, T. C. Terwilliger, A. G. Urzhumtsev, L. L. Videau, C. J. Williams & P. D. Adams (2019). Acta Cryst. D75, 861-877. 
An epoxide hydrolase from endophytic Streptomyces shows unique structural features and wide biocatalytic activity. G. D. Tormet-González, C. Wilson, G. S. de Oliveira, J. C. dos Santos, L. G. de Oliveira & M. V. B. Dias (2020). Acta Cryst. D76, 868-875. 
Methods for merging data sets in electron cryo-microscopy. M. E. Wilkinson, A. Kumar & A. Casañal (2019). Acta Cryst. D75, 782-791. 
Industrial cryo-EM facility setup and management. K. Sader, R. Matadeen, P. Castro Hartmann, T. Halsan & C. Schlichten (2020). Acta Cryst. D76, 313-325. 
Homogeneously N-glycosylated proteins derived from the GlycoDelete HEK293 cell line enable diffraction-quality crystallogenesis. S. Kozak, Y. Bloch, S. De Munck, A. Mikula, I. Bento, S. N. Savvides & R. Meijers (2020). Acta Cryst. D76, 1244-1255. 
Shake-it-off: a simple ultrasonic cryo-EM specimen-preparation device. J. L. Rubinstein, H. Guo, Z. A. Ripstein, A. Haydaroglu, A. Au, C. M. Yip, J. M. Di Trani, S. Benlekbir & T. Kwok (2019). Acta Cryst. D75, 1063-1070. 
Amyloid structure determination in RELION-3.1. S. H. W. Scheres (2020). Acta Cryst. D76, 94-101. 
Non-merohedral twinning: from minerals to proteins. M. Sevvana, M. Ruf, I. Usón, G. M. Sheldrick & R. Herbst-Irmer (2019). Acta Cryst. D75, 1040-1050. 
Structure of a GH51 α-L-arabinofuranosidase from Meripilus giganteus: conserved substrate recognition from bacteria to fungi. N. G. S. McGregor, J. P. Turkenburg, K. B. R. Mørkeberg Krogh, J. E. Nielsen, M. Artola, K. A. Stubbs, H. S. Overkleeft & G. J. Davies (2020). Acta Cryst. D76, 1124-1133. 
Statistically correcting dynamical electron scattering improves the refinement of protein nanocrystals, including charge refinement of coordinated metals. T. B. Blum, D. Housset, M. T. B. Clabbers, E. van Genderen, M. Bacia-Verloop, U. Zander, A. A. McCarthy, G. Schoehn, W. L. Ling & J. P. Abrahams (2021). Acta Cryst. D77, 75-85. 
The copper(II)-binding tripeptide GHK, a valuable crystallization and phasing tag for macromolecular crystallography. A. Mehr, F. Henneberg, A. Chari, D. Görlich & T. Huyton (2020). Acta Cryst. D76, 1222-1232. 
Development and assessment of CootVR, a virtual reality computer program for model building. H. Todd & P. Emsley (2021). Acta Cryst. D77, 19-27. 
Macromolecular crystallography using microcrystal electron diffraction. M. T. B. Clabbers & H. Xu (2021). Acta Cryst. D77, 313-324. 
High-performance macromolecular data delivery and visualization for the web. D. Sehnal, R. Svobodová, K. Berka, A. S. Rose, S. K. Burley, S. Velankar & J. Koča (2020). Acta Cryst. D76, 1167-1173. 
Phasertng: directed acyclic graphs for crystallographic phasing. A. J. McCoy, D. H. Stockwell, M. D. Sammito, R. D. Oeffner, K. S. Hatti, T. I. Croll & R. J. Read (2021). Acta Cryst. D77, 1-10. 
C-phycocyanin as a highly attractive model system in protein crystallography: unique crystallization properties and packing-diversity screening. I. Sarrou, C. G. Feiler, S. Falke, N. Peard, O. Yefanov & H. Chapman (2021). Acta Cryst. D77, 224-236. 
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CRYSTALLOGRAPHIC
COMMUNICATIONS
Crystal structure, DFT study and Hirshfeld surface analysis of 1-nonyl-2,3-di­hydro-1H-indole-2,3-dione. I. Rayni, Y. El Bakri, C.-H. Lai, J. Sebhaoui, E. M. Essassi & J. T. Mague (2019). Acta Cryst. E75, 1140-1144. 
2-O-Monoalkyl isosorbide ethers with C8, C10, C12 and C14 chain lengths. F. Geburtig & V. Vill (2020). Acta Cryst. E76, 924-928. 
checkCIF validation ALERTS: what they mean and how to respond. A. L. Spek (2020). Acta Cryst. E76, 1-11. 
Crystal structure and Hirshfeld surface analysis of 4-(naphthalen-2-yl)-N-[(Z)-4-propoxybenzyl­idene]-1,3-thia­zol-2-amine. R. A. Sheakh Mohamad, W. M. Hamad & H. J. Aziz (2020). Acta Cryst. E76, 920-923. 
Crystal structure and Hirshfeld surface analysis of (E)-N-(4-propyl­oxybenzyl­idene)benzo[d]thia­zol-2-amine. R. A. Sheakh Mohamad, W. M. Hamad, H. J. Aziz & N. Dege (2020). Acta Cryst. E76, 1591-1594. 
Crystal structures of two dysprosium–aluminium–sodium [3.3.1] metallacryptates that form two-dimensional sheets. J. R. Travis, G. P. Van Trieste III, M. Zeller & C. M. Zaleski (2020). Acta Cryst. E76, 1378-1390. 
Crystal structure and Hirshfeld surface analysis of 4-{[(E)-4-(hept­yloxy)benzyl­idene]amino}-N-(naphthalen-2-yl)-1,3-thia­zol-2-amine. R. A. Sheakh Mohamad, H. J. Aziz & W. M. Hamad (2020). Acta Cryst. E76, 1092-1095. 
Syntheses and crystal structures of three [M(acac)2(TMEDA)] complexes (M = Mn, Fe and Zn). J. H. Halz, C. Heiser, C. Wagner & K. Merzweiler (2020). Acta Cryst. E76, 66-71. 
Crystallographic and spectroscopic characterization of 3-chloro-5-fluoro­salicyl­aldehyde. C. T. Triggs & J. M. Tanski (2020). Acta Cryst. E76, 1810-1812. 
Crystal structure of the RuPhos ligand. K. M. Carsch, W. Ho, K. H. Lui, G. Valtierra, D. K. Dogutan, D. G. Nocera & S.-L. Zheng (2021). Acta Cryst. E77, 171-174. 
Norpsilocin: freebase and fumarate salt. A. R. Chadeayne, D. N. K. Pham, J. A. Golen & D. R. Manke (2020). Acta Cryst. E76, 589-593. 
Synthesis, crystal structure, Hirshfeld surface analysis, MEP study and mol­ecular docking of N-{3-[(4-meth­oxy­phen­yl)carbamo­yl]phen­yl}-3-nitro­benzamide as a promising inhibitor of hfXa. R. Moreno-Fuquen, M. Hurtado-Angulo, K. Arango-Daraviña, G. Bain & A. R. Kennedy (2020). Acta Cryst. E76, 1762-1767. 
Psilacetin derivatives: fumarate salts of the meth­yl–ethyl, meth­yl–allyl and diallyl variants of the psilocin prodrug. D. N. K. Pham, A. R. Chadeayne, J. A. Golen & D. R. Manke (2021). Acta Cryst. E77, 101-106. 
Obtaining the best results: aspects of data collection, model finalization and inter­pretation of results in small-mol­ecule crystal-structure determination. A. Linden (2020). Acta Cryst. E76, 765-775. 
Nickel(II) carbonyl, ammonia, and aceto­nitrile complexes supported by a pyridine dipyrrolide pincer ligand. H. V. R. Dias & A. Pramanik (2020). Acta Cryst. E76, 1741-1747. 
Two acyclic imides: 3-bromo-N-(3-bromo­benzo­yl)-N-(pyridin-2-yl)benzamide and 3-bromo-N-(3-bromo­benzo­yl)-N-(pyrimidin-2-yl)benzamide. F. Desmond, J. F. Gallagher & N. Hehir (2020). Acta Cryst. E76, 1800-1804. 
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STRUCTURAL BIOLOGY
COMMUNICATIONS
Structure of the archaeal chemotaxis protein CheY in a domain-swapped dimeric conformation. K. S. Paithankar, M. Enderle, D. C. Wirthensohn, A. Miller, M. Schlesner, F. Pfeiffer, A. Rittner, M. Grininger & D. Oesterhelt (2019). Acta Cryst. F75, 576-585. 
Computer-controlled liquid-nitrogen drizzling device for removing frost from cryopreserved crystals. Y. Nakamura, S. Baba, N. Mizuno, T. Irie, G. Ueno, K. Hirata, S. Ito, K. Hasegawa, M. Yamamoto & T. Kumasaka (2020). Acta Cryst. F76, 616-622. 
Room-temperature neutron and X-ray data collection of 3CL Mpro from SARS-CoV-2. D. W. Kneller, G. Phillips, A. Kovalevsky & L. Coates (2020). Acta Cryst. F76, 483-487. 
The A component (SmhA) of a tripartite pore-forming toxin from Serratia marcescens: expression, purification and crystallographic analysis. A. M. Churchill-Angus, S. E. Sedelnikova, T. H. B. Schofield & P. J. Baker (2020). Acta Cryst. F76, 577-582. 
A new soaking procedure for X-ray crystallographic structural determination of protein–peptide complexes. A. Ballone, R. A. Lau, F. P. A. Zweipfenning & C. Ottmann (2020). Acta Cryst. F76, 501-507. 
Structural analysis of the chicken FANCM–MHF complex and its stability. S. Ito & T. Nishino (2021). Acta Cryst. F77, 1-7. 
A fully automated crystallization apparatus for small protein quantities. R. Kato, M. Hiraki, Y. Yamada, M. Tanabe & T. Senda (2021). Acta Cryst. F77, 29-36. 
The X-ray crystal structure of the N-terminal domain of Ssr4, a Schizosaccharomyces pombe chromatin-remodelling protein. J. Newman, T. Nebl, H. Van & T. S. Peat (2020). Acta Cryst. F76, 583-589. 
The hypothetical periplasmic protein PA1624 from Pseudomonas aeruginosa folds into a unique two-domain structure. C. G. Feiler, M. S. Weiss & W. Blankenfeldt (2020). Acta Cryst. F76, 609-615. 
Structural and biochemical characterization of the class II fructose-1,6-bisphosphatase from Francisella tularensis. A. I. Selezneva, H. J. Gutka, N. M. Wolf, F. Qurratulain, F. Movahedzadeh & C. Abad-Zapatero (2020). Acta Cryst. F76, 524-535. 
Crystal structure of human CRM1, covalently modified by 2-mercaptoethanol on Cys528, in complex with RanGTP. A. Shaikhqasem, K. Schmitt, O. Valerius & R. Ficner (2021). Acta Cryst. F77, 70-78. 
Crystallization and structure of ebselen bound to Cys141 of human inositol monophosphatase. G. D. Fenn, H. Waller-Evans, J. R. Atack & B. D. Bax (2020). Acta Cryst. F76, 469-476. 
Crystal structures of native cytochrome c6 from Thermosynechococcus elongatus in two different space groups and implications for its oligomerization. S. Falke, C. Feiler, H. Chapman & I. Sarrou (2020). Acta Cryst. F76, 444-452. 
Structure of the substrate-binding domain of Plasmodium falciparum heat-shock protein 70-x. J. Schmidt & I. Vakonakis (2020). Acta Cryst. F76, 495-500. 
High-resolution crystal structures of Escherichia coli FtsZ bound to GDP and GTP. M. A. Schumacher, T. Ohashi, L. Corbin & H. P. Erickson (2020). Acta Cryst. F76, 94-102. 
Proline/alanine-rich sequence (PAS) polypeptides as an alternative to PEG precipitants for protein crystallization. A. Schiefner, R. Walser, M. Gebauer & A. Skerra (2020). Acta Cryst. F76, 320-325. 
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IUCrJ
Photocrystallographic and spectroscopic studies of a model (N,N,O)-donor square-planar nickel(II) nitro complex: in search of high-conversion and stable photoswitchable materials. S. E. Kutniewska, A. Krówczyński, R. Kamiński, K. N. Jarzembska, S. Pillet, E. Wenger & D. Schaniel (2020). IUCrJ 7, 1188-1198. 
Distortions, deviations and alternative facts: reliability in crystallography. W. Clegg (2021). IUCrJ 8, 4-11. 
Molecular determinants of vascular transport of dexamethasone in COVID-19 therapy. I. G. Shabalin, M. P. Czub, K. A. Majorek, D. Brzezinski, M. Grabowski, D. R. Cooper, M. Panasiuk, M. Chruszcz & W. Minor (2020). IUCrJ 7, 1048-1058. 
Exploiting prior knowledge about biological macromolecules in cryo-EM structure determination. D. Kimanius, G. Zickert, T. Nakane, J. Adler, S. Lunz, C.-B. Schönlieb, O. Öktem & S. H. W. Scheres (2021). IUCrJ 8, 60-75. 
Enhancing the signal-to-noise ratio and generating contrast for cryo-EM images with convolutional neural networks. E. Palovcak, D. Asarnow, M. G. Campbell, Z. Yu & Y. Cheng (2020). IUCrJ 7, 1142-1150. 
Complex imaging of phase domains by deep neural networks. L. Wu, P. Juhas, S. Yoo & I. Robinson (2021). IUCrJ 8, 12-21. 
Continuous flexibility analysis of SARS-CoV-2 spike prefusion structures. R. Melero, C. O. S. Sorzano, B. Foster, J.-L. Vilas, M. Martínez, R. Marabini, E. Ramírez-Aportela, R. Sanchez-Garcia, D. Herreros, L. del Caño, P. Losana, Y. C. Fonseca-Reyna, P. Conesa, D. Wrapp, P. Chacon, J. S. McLellan, H. D. Tagare & J.-M. Carazo (2020). IUCrJ 7, 1059-1069. 
Room-temperature X-ray crystallography reveals the oxidation and reactivity of cysteine residues in SARS-CoV-2 3CL Mpro: insights into enzyme mechanism and drug design. D. W. Kneller, G. Phillips, H. M. O'Neill, K. Tan, A. Joachimiak, L. Coates & A. Kovalevsky (2020). IUCrJ 7, 1028-1035. 
The structure of kaliophilite KAlSiO4, a long-lasting crystallographic problem. E. Mugnaioli, E. Bonaccorsi, A. E. Lanza, E. Elkaim, V. Diez-Gómez, I. Sobrados, M. Gemmi & M. Gregorkiewitz (2020). IUCrJ 7, 1070-1083. 
Crystal forms in pharmaceutical applications: olanzapine, a gift to crystal chemistry that keeps on giving. S. M. Reutzel-Edens & R. M. Bhardwaj (2020). IUCrJ 7, 955-964. 
Devitrification reduces beam-induced movement in cryo-EM. J.-P. Wieferig, D. J. Mills & W. Kühlbrandt (2021). IUCrJ 8, 186-194. 
Local and long-range atomic/magnetic structure of non-stoichiometric spinel iron oxide nanocrystallites. H. L. Andersen, B. A. Frandsen, H. P. Gunnlaugsson, M. R. V. Jørgensen, S. J. L. Billinge, K. M. Ø. Jensen & M. Christensen (2021). IUCrJ 8, 33-45. 
Advances in long-wavelength native phasing at X-ray free-electron lasers. K. Nass, R. Cheng, L. Vera, A. Mozzanica, S. Redford, D. Ozerov, S. Basu, D. James, G. Knopp, C. Cirelli, I. Martiel, C. Casadei, T. Weinert, P. Nogly, P. Skopintsev, I. Usov, F. Leonarski, T. Geng, M. Rappas, A. S. Doré, R. Cooke, S. Nasrollahi Shirazi, F. Dworkowski, M. Sharpe, N. Olieric, C. Bacellar, R. Bohinc, M. O. Steinmetz, G. Schertler, R. Abela, L. Patthey, B. Schmitt, M. Hennig, J. Standfuss, M. Wang & C. J. Milne (2020). IUCrJ 7, 965-975. 
Beyond integration: modeling every pixel to obtain better structure factors from stills. D. Mendez, R. Bolotovsky, A. Bhowmick, A. S. Brewster, J. Kern, J. Yano, J. M. Holton & N. K. Sauter (2020). IUCrJ 7, 1151-1167. 
Crystal structures of SARS-CoV-2 ADP-ribose phosphatase: from the apo form to ligand complexes. K. Michalska, Y. Kim, R. Jedrzejczak, N. I. Maltseva, L. Stols, M. Endres & A. Joachimiak (2020). IUCrJ 7, 814-824. 
Comparing serial X-ray crystallography and microcrystal electron diffraction (MicroED) as methods for routine structure determination from small macromolecular crystals. A. M. Wolff, I. D. Young, R. G. Sierra, A. S. Brewster, M. W. Martynowycz, E. Nango, M. Sugahara, T. Nakane, K. Ito, A. Aquila, A. Bhowmick, J. T. Biel, S. Carbajo, A. E. Cohen, S. Cortez, A. Gonzalez, T. Hino, D. Im, J. D. Koralek, M. Kubo, T. S. Lazarou, T. Nomura, S. Owada, A. J. Samelson, T. Tanaka, R. Tanaka, E. M. Thompson, H. van den Bedem, R. A. Woldeyes, F. Yumoto, W. Zhao, K. Tono, S. Boutet, S. Iwata, T. Gonen, N. K. Sauter, J. S. Fraser & M. C. Thompson (2020). IUCrJ 7, 306-323. 
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Grazing-incidence X-ray diffraction investigation of the coincidence site lattice of the Ge/Si(001) system. Y. Barnscheidt, J. Schmidt & H. J. Osten (2020). J. Appl. Cryst. 53, 1212-1216. 
Mercury 4.0: from visualization to analysis, design and prediction. C. F. Macrae, I. Sovago, S. J. Cottrell, P. T. A. Galek, P. McCabe, E. Pidcock, M. Platings, G. P. Shields, J. S. Stevens, M. Towler & P. A. Wood (2020). J. Appl. Cryst. 53, 226-235. 
ATSAS 3.0: expanded functionality and new tools for small-angle scattering data analysis. K. Manalastas-Cantos, P. V. Konarev, N. R. Hajizadeh, A. G. Kikhney, M. V. Petoukhov, D. S. Molodenskiy, A. Panjkovich, H. D. T. Mertens, A. Gruzinov, C. Borges, C. M. Jeffries, D. I. Svergun & D. Franke (2021). J. Appl. Cryst. 54, 343-355. 
Raman Open Database: first interconnected Raman–X-ray diffraction open-access resource for material identification. Y. El Mendili, A. Vaitkus, A. Merkys, S. Gražulis, D. Chateigner, F. Mathevet, S. Gascoin, S. Petit, J.-F. Bardeau, M. Zanatta, M. Secchi, G. Mariotto, A. Kumar, M. Cassetta, L. Lutterotti, E. Borovin, B. Orberger, P. Simon, B. Hehlen & M. Le Guen (2019). J. Appl. Cryst. 52, 618-625. 
Demonstration of electron diffraction from membrane protein crystals grown in a lipidic mesophase after lamella preparation by focused ion beam milling at cryogenic temperatures. V. Polovinkin, K. Khakurel, M. Babiak, B. Angelov, B. Schneider, J. Dohnalek, J. Andreasson & J. Hajdu (2020). J. Appl. Cryst. 53, 1416-1424. 
First ptychographic X-ray computed tomography experiment on the NanoMAX beamline. M. Kahnt, S. Sala, U. Johansson, A. Björling, Z. Jiang, S. Kalbfleisch, F. Lenrick, J. H. Pikul & K. Thånell (2020). J. Appl. Cryst. 53, 1444-1451. 
Teaching periodicity and aperiodicity using 3D-printed tiles and polyhedra. L. Casas (2020). J. Appl. Cryst. 53, 1583-1592. 
BornAgain: software for simulating and fitting grazing-incidence small-angle scattering. G. Pospelov, W. Van Herck, J. Burle, J. M. Carmona Loaiza, C. Durniak, J. M. Fisher, M. Ganeva, D. Yurov & J. Wuttke (2020). J. Appl. Cryst. 53, 262-276. 
High-performance Python for crystallographic computing. A. Boulle & J. Kieffer (2019). J. Appl. Cryst. 52, 882-897. 
The XBI BioLab for life science experiments at the European XFEL. H. Han, E. Round, R. Schubert, Y. Gül, J. Makroczyová, D. Meza, P. Heuser, M. Aepfelbacher, I. Barák, C. Betzel, P. Fromme, I. Kursula, P. Nissen, E. Tereschenko, J. Schulz, C. Uetrecht, J. Ulicný, M. Wilmanns, J. Hajdu, V. S. Lamzin & K. Lorenzen (2021). J. Appl. Cryst. 54, 7-21. 
Rietveld in 100 picoseconds. B. H. Toby (2021). J. Appl. Cryst. 54, 1-2. 
Application of precise neutron focusing mirrors for neutron reflectometry: latest results and future prospects. N. L. Yamada, T. Hosobata, F. Nemoto, K. Hori, M. Hino, J. Izumi, K. Suzuki, M. Hirayama, R. Kanno & Y. Yamagata (2020). J. Appl. Cryst. 53, 1462-1470. 
Upscaling X-ray nanoimaging to macroscopic specimens. M. Du, Z. Di, D. Gürsoy, R. P. Xian, Y. Kozorovitskiy & C. Jacobsen (2021). J. Appl. Cryst. 54, 386-401. 
speckle-tracking: a software suite for ptychographic X-ray speckle tracking. A. J. Morgan, K. T. Murray, H. M. Quiney, S. Bajt & H. N. Chapman (2020). J. Appl. Cryst. 53, 1603-1612. 
Visualization of texture components using MTEX. G. Rafailov, E. N. Caspi, R. Hielscher, E. Tiferet, R. Schneck & S. C. Vogel (2020). J. Appl. Cryst. 53, 540-548. 
An operando spatially resolved study of alkaline battery discharge using a novel hyperspectral detector and X-ray tomography. T. Connolley, O. V. Magdysyuk, S. Michalik, P. K. Allan, M. Klaus, P. H. Kamm, F. Garcia-Moreno, J. A. Nelson, M. C. Veale & M. D. Wilson (2020). J. Appl. Cryst. 53, 1434-1443. 
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JOURNAL OF
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RADIATION
Tomographic reconstruction with a generative adversarial network. X. Yang, M. Kahnt, D. Brückner, A. Schropp, Y. Fam, J. Becher, J.-D. Grunwaldt, T. L. Sheppard & C. G. Schroer (2020). J. Synchrotron Rad. 27, 486-493. 
Single-pulse phase-contrast imaging at free-electron lasers in the hard X-ray regime. J. Hagemann, M. Vassholz, H. Hoeppe, M. Osterhoff, J. M. Rosselló, R. Mettin, F. Seiboth, A. Schropp, J. Möller, J. Hallmann, C. Kim, M. Scholz, U. Boesenberg, R. Schaffer, A. Zozulya, W. Lu, R. Shayduk, A. Madsen, C. G. Schroer & T. Salditt (2021). J. Synchrotron Rad. 28, 52-63. 
The versatile X-ray beamline of the Munich Compact Light Source: design, instrumentation and applications. B. Günther, R. Gradl, C. Jud, E. Eggl, J. Huang, S. Kulpe, K. Achterhold, B. Gleich, M. Dierolf & F. Pfeiffer (2020). J. Synchrotron Rad. 27, 1395-1414. 
3D virtual histology of human pancreatic tissue by multiscale phase-contrast X-ray tomography. J. Frohn, D. Pinkert-Leetsch, J. Missbach-Güntner, M. Reichardt, M. Osterhoff, F. Alves & T. Salditt (2020). J. Synchrotron Rad. 27, 1707-1719. 
The SwissFEL soft X-ray free-electron laser beamline: Athos. R. Abela, A. Alarcon, J. Alex, C. Arrell, V. Arsov, S. Bettoni, M. Bopp, C. Bostedt, H.-H. Braun, M. Calvi, T. Celcer, P. Craievich, A. Dax, P. Dijkstal, S. Dordevic, E. Ferrari, U. Flechsig, R. Follath, F. Frei, N. Gaiffi, Z. Geng, C. Gough, N. Hiller, S. Hunziker, M. Huppert, R. Ischebeck, H. Jöhri, P. Juranic, R. Kalt, M. Kaiser, B. Keil, C. Kittel, R. Künzi, T. Lippuner, F. Löhl, F. Marcellini, G. Marinkovic, C. Ozkan Loch, G. L. Orlandi, B. Patterson, C. Pradervand, M. Paraliev, M. Pedrozzi, E. Prat, P. Ranitovic, S. Reiche, C. Rosenberg, S. Sanfilippo, T. Schietinger, T. Schmidt, K. Schnorr, C. Svetina, A. Trisorio, C. Vicario, D. Voulot, U. Wagner, H. J. Wörner, A. Zandonella, L. Patthey & R. Ganter (2019). J. Synchrotron Rad. 26, 1073-1084. 
HIPPIE: a new platform for ambient-pressure X-ray photoelectron spectroscopy at the MAX IV Laboratory. S. Zhu, M. Scardamaglia, J. Kundsen, R. Sankari, H. Tarawneh, R. Temperton, L. Pickworth, F. Cavalca, C. Wang, H. Tissot, J. Weissenrieder, B. Hagman, J. Gustafson, S. Kaya, F. Lindgren, I. Källquist, J. Maibach, M. Hahlin, V. Boix, T. Gallo, F. Rehman, G. D'Acunto, J. Schnadt & A. Shavorskiy (2021). J. Synchrotron Rad. 28, 624-636. 
Multi-analyser detector (MAD) for high-resolution and high-energy powder X-ray diffraction. A. Schökel, M. Etter, A. Berghäuser, A. Horst, D. Lindackers, T. A. Whittle, S. Schmid, M. Acosta, M. Knapp, H. Ehrenberg & M. Hinterstein (2021). J. Synchrotron Rad. 28, 146-157. 
Correction of the X-ray wavefront from compound refractive lenses using 3D printed refractive structures. V. Dhamgaye, D. Laundy, S. Baldock, T. Moxham & K. Sawhney (2020). J. Synchrotron Rad. 27, 1518-1527. 
ROBL-II at ESRF: a synchrotron toolbox for actinide research. A. C. Scheinost, J. Claussner, J. Exner, M. Feig, S. Findeisen, C. Hennig, K. O. Kvashnina, D. Naudet, D. Prieur, A. Rossberg, M. Schmidt, C. Qiu, P. Colomp, C. Cohen, E. Dettona, V. Dyadkin & T. Stumpf (2021). J. Synchrotron Rad. 28, 333-349. 
Characterization of the Percival detector with soft X-rays. A. Marras, J. Correa, S. Lange, V. Vardanyan, T. Gerhardt, M. Kuhn, F. Krivan, I. Shevyakov, M. Zimmer, M. Hoesch, K. Bagschik, F. Scholz, N. Guerrini, B. Marsh, I. Sedgwick, G. Cautero, D. Giuressi, G. Iztok, R. H. Menk, M. Scarcia, L. Stebel, T. Nicholls, W. Nichols, U. K Pedersen, P. Shikhaliev, N. Tartoni, H. Hyun, S. Kim, K. Kim, S. Rah, A. Dawiec, F. Orsini, G. Pinaroli, A. Greer, S. Aplin, A. D. Jewell, T. J. Jones, S. Nikzad, M. E. Hoenk, F. Okrent, H. Graafsma & C. B. Wunderer (2021). J. Synchrotron Rad. 28, 131-145. 
A phase-retrieval toolbox for X-ray holography and tomography. L. M. Lohse, A.-L. Robisch, M. Töpperwien, S. Maretzke, M. Krenkel, J. Hagemann & T. Salditt (2020). J. Synchrotron Rad. 27, 852-859. 
Fast convolution-based performance estimation method for diffraction-limited source with imperfect X-ray optics. L. Hu, J. P. Sutter & H. Wang (2020). J. Synchrotron Rad. 27, 1539-1552. 
Hard X-ray ptychography for optics characterization using a partially coherent synchrotron source. T. E. J. Moxham, A. Parsons, T. Zhou, L. Alianelli, H. Wang, D. Laundy, V. Dhamgaye, O. J. L. Fox, K. Sawhney & A. M. Korsunsky (2020). J. Synchrotron Rad. 27, 1688-1695. 
Wigner distribution of self-amplified spontaneous emission free-electron laser pulses and extracting its autocorrelation. S. Serkez, O. Gorobtsov, D. E. Rivas, M. Meyer, B. Sobko, N. Gerasimova, N. Kujala & G. Geloni (2021). J. Synchrotron Rad. 28, 3-17. 
High-resolution macromolecular crystallography at the FemtoMAX beamline with time-over-threshold photon detection. M. Jensen, V. Ahlberg Gagnér, J. Cabello Sánchez, Å.U. J. Bengtsson, J. C. Ekström, T. Björg Úlfarsdóttir, M.-J. Garcia-Bonete, A. Jurgilaitis, D. Kroon, V.-T. Pham, S. Checcia, H. Coudert-Alteirac, S. Schewa, M. Rössle, H. Rodilla, J. Stake, V. Zhaunerchyk, J. Larsson & G. Katona (2021). J. Synchrotron Rad. 28, 64-70. 
Mjölnir: a miniature triaxial rock deformation apparatus for 4D synchrotron X-ray microtomography. I. Butler, F. Fusseis, A. Cartwright-Taylor & M. Flynn (2020). J. Synchrotron Rad. 27, 1681-1687. 
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IUCrData
The hydro­chloride salt of 4-hy­droxy-N,N-di-n-propyl­tryptamine (4-HO-DPT). V. R. Sammeta, S. Rasapalli, A. R. Chadeayne, J. A. Golen & D. R. Manke (2020). IUCrData 5, x201546. 
5-MeO-DALT: the freebase of N,N-diallyl-5-meth­oxy­tryptamine. A. R. Chadeayne, D. N. K. Pham, J. A. Golen & D. R. Manke (2020). IUCrData 5, x200498. 
2H-[1,3]Thia­zolo[5,4,3-ij]quinolin-3-ium chloride monohydrate. M. A. Ehweiner, F. Belaj & N. C. Mösch-Zanetti (2020). IUCrData 5, x201465. 
Poly[(μ4-phenyl­phospho­nato)zinc(II)]. L. Falvello, P. Lotti, C. Massera, S. C. Tarantino, M. Zema, H. Puschmann, M. Y. Agbahoungbata, J. Andreo, S. A. Sahadevan, A. Bismuto, G. Bonfant, S. A. S. Bonou, C. Carraro, M. D. Zotti, A. di Biase, R. Fantini, I. Ferraboschi, J. M. F. Custodio, M. Frigerio, G. Gallo, S. Gjyli, M. Goudjil, F. Igoa, E. Kahveci, M. Kalienko, S. Lorenzon, L. Macera, J. J. M. Fajardo, E. Nushi, S. Ouaatta, E. Parisi, L. Pasqualetto, E. Pesko, G. Pierri, R. Pinalli, R. Poppe, A. Santoro, E. Smirnova, S. Sorbara, L. Tensi & G. Tusha (2019). IUCrData 4, x191222. 
(3,5-Dimethyl-1H-pyrazol-1-yl)tri­methyl­silane. U. Böhme & F. Bitto (2020). IUCrData 5, x201444. 
Crystal structure of 2-[(naphthalen-2-yl)meth­yl]iso­thio­uronium bromide. V. Eigner (2020). IUCrData 5, x201511. 
Synthesis and crystal structure of [Cs([2.2.2]crypt)]2[Mo(CO)5]. M. Kaas & N. Korber (2019). IUCrData 4, x191244. 
cis-{1-Butyl-3-[2-(phenyl­sulfan­yl)eth­yl]-4-imidazolin-2-yl-κ2C2,S′}di­chlorido­platinum(II). B.-B. Liang, H.-G. Xiong, W.-Y. Hong & H.-G. Yao (2020). IUCrData 5, x201433. 
(E)-3-Thia-1,5(1,3)-dibenzena­cyclo­undeca­phan-8-ene-6,11-dione 3,3-dioxide. S. Kotha, N. K. Gupta & S. Ansari (2020). IUCrData 5, x201464. 
6-[(2-Hy­droxy-5-methyl­anilino)methyl­idene]-4-nitro­cyclo­hexa-2,4-dien-1-one. U. Böhme & S. Fels (2020). IUCrData 5, x201384. 
1-(3,5-Di­nitro­benzo­yl)-4-(2-meth­oxy­phen­yl)piper­azine. C. Harish Chinthal, C. N. Kavitha, H. S. Yathirajan, S. Foro & C. Glidewell (2020). IUCrData 5, x201523. 
D-Glutamic acid hydro­chloride. L. Y. Fox-Uribe, J. Hernández-Paredes, Y. Soberanes, I. Valenzuela-Chavira, K. D. Garcia-Orozco, A. Ochoa-Leyva, K. O. Lara, R. E. Navarro & R. R. Sotelo-Mundo (2019). IUCrData 4, x190458. 
Pyridine-4-carboxamidoxime N-oxide. C. W. Padgett, K. Sheriff & W. E. Lynch (2020). IUCrData 5, x201335. 
(E)-2-(3,5-Di­meth­oxy­benzyl­idene)indan-1-one. E. Encarnacion-Thomas, R. D. Sommer, A. Mallia & J. Sloop (2020). IUCrData 5, x200759. 
4-(Di­methyl­amino)­benzohydrazide. S. P. Kelley, V. V. Mossine & T. P. Mawhinney (2020). IUCrData 5, x201310. 
catena-Poly[barium(II)-μ2-(dimethyl sulfoxide)-κ2O:O-bis­(μ2-2,4,6-tri­nitro­phenolato-κ4O2,O1:O1,O6)]. B. R. Srinivasan, N. U. Parsekar & K. U. Narvekar (2020). IUCrData 5, x201498. 
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