000474903 001__ 474903
000474903 005__ 20250715173332.0
000474903 0247_ $$2doi$$a10.1107/S2053273323000682
000474903 0247_ $$2ISSN$$a0108-7673
000474903 0247_ $$2ISSN$$a0567-7394
000474903 0247_ $$2ISSN$$a1600-5724
000474903 0247_ $$2ISSN$$a1600-8596
000474903 0247_ $$2ISSN$$a2053-2733
000474903 0247_ $$2datacite_doi$$a10.3204/PUBDB-2022-01059
000474903 0247_ $$2altmetric$$aaltmetric:142677606
000474903 0247_ $$2pmid$$a36862040
000474903 0247_ $$2WOS$$aWOS:000942386400002
000474903 0247_ $$2openalex$$aopenalex:W4321230049
000474903 037__ $$aPUBDB-2022-01059
000474903 041__ $$aEnglish
000474903 082__ $$a530
000474903 1001_ $$0P:(DE-H253)PIP1033390$$aBrehm, Wolfgang$$b0$$eCorresponding author
000474903 245__ $$aCrystal diffraction prediction and partiality estimation using Gaussian basis functions
000474903 260__ $$aOxford [u.a.]$$bBlackwell$$c2023
000474903 3367_ $$2DRIVER$$aarticle
000474903 3367_ $$2DataCite$$aOutput Types/Journal article
000474903 3367_ $$0PUB:(DE-HGF)16$$2PUB:(DE-HGF)$$aJournal Article$$bjournal$$mjournal$$s1718782728_3773429
000474903 3367_ $$2BibTeX$$aARTICLE
000474903 3367_ $$2ORCID$$aJOURNAL_ARTICLE
000474903 3367_ $$00$$2EndNote$$aJournal Article
000474903 520__ $$aThe recent diversification in macromolecular crystallographic experiments to pink beams, convergent electron diffraction and serial crystallography has shown the limitations of using the Laue equations for diffraction prediction. This publication aims to give a straightforward way of calculating approximate crystal diffraction patterns given varying distributions of the incoming beam, crystal shapes and other potentially hidden parameters. This approach models each pixel of a diffraction pattern and improves data processing of integrated peak intensities by enabling the correction of partially recorded reflections.The fundamental idea is to express the distributions as weighted sums of Gaussian functions.
000474903 536__ $$0G:(DE-HGF)POF4-631$$a631 - Matter – Dynamics, Mechanisms and Control (POF4-631)$$cPOF4-631$$fPOF IV$$x0
000474903 536__ $$0G:(GEPRIS)390715994$$aDFG project 390715994 - EXC 2056: CUI: Advanced Imaging of Matter (390715994)$$c390715994$$x1
000474903 536__ $$0G:(GEPRIS)194651731$$aDFG project 194651731 - EXC 1074: Hamburger Zentrum für ultraschnelle Beobachtung (CUI): Struktur, Dynamik und Kontrolle von Materie auf atomarer Skala (194651731)$$c194651731$$x2
000474903 588__ $$aDataset connected to CrossRef, Journals: bib-pubdb1.desy.de
000474903 693__ $$0EXP:(DE-H253)XFEL(machine)-20150101$$1EXP:(DE-H253)XFEL-20150101$$5EXP:(DE-H253)XFEL(machine)-20150101$$aXFEL$$eFacility (machine) XFEL$$x0
000474903 7001_ $$0P:(DE-H253)PIP1010779$$aWhite, Thomas$$b1
000474903 7001_ $$0P:(DE-H253)PIP1006324$$aChapman, Henry N.$$b2$$eCorresponding author
000474903 773__ $$0PERI:(DE-600)2020844-3$$a10.1107/S2053273323000682$$gVol. 79, no. 2, p. 145 - 162$$n2$$p145 - 162$$tActa crystallographica / A$$v79$$x0108-7673$$y2023
000474903 8564_ $$uhttps://bib-pubdb1.desy.de/record/474903/files/HTML-Approval_of_scientific_publication.html
000474903 8564_ $$uhttps://bib-pubdb1.desy.de/record/474903/files/PDF-Approval_of_scientific_publication.pdf
000474903 8564_ $$uhttps://bib-pubdb1.desy.de/record/474903/files/document.pdf
000474903 8564_ $$uhttps://bib-pubdb1.desy.de/record/474903/files/internal_review.pdf
000474903 8564_ $$uhttps://bib-pubdb1.desy.de/record/474903/files/document.pdf?subformat=pdfa$$xpdfa
000474903 8564_ $$uhttps://bib-pubdb1.desy.de/record/474903/files/internal_review.pdf?subformat=pdfa$$xpdfa
000474903 8564_ $$uhttps://bib-pubdb1.desy.de/record/474903/files/Generalized_Gaussian_Diffraction_Model--Authors_Latest_Fulltext.pdf$$yOpenAccess$$zStatID:(DE-HGF)0510
000474903 8564_ $$uhttps://bib-pubdb1.desy.de/record/474903/files/Generalized_Gaussian_Diffraction_Model2.pdf$$yRestricted$$zStatID:(DE-HGF)0599
000474903 8564_ $$uhttps://bib-pubdb1.desy.de/record/474903/files/ik5005.pdf$$yRestricted$$zStatID:(DE-HGF)0599
000474903 8564_ $$uhttps://bib-pubdb1.desy.de/record/474903/files/Generalized_Gaussian_Diffraction_Model--Authors_Latest_Fulltext.pdf?subformat=pdfa$$xpdfa$$yOpenAccess$$zStatID:(DE-HGF)0510
000474903 8564_ $$uhttps://bib-pubdb1.desy.de/record/474903/files/Generalized_Gaussian_Diffraction_Model2.pdf?subformat=pdfa$$xpdfa$$yRestricted$$zStatID:(DE-HGF)0599
000474903 8564_ $$uhttps://bib-pubdb1.desy.de/record/474903/files/ik5005.pdf?subformat=pdfa$$xpdfa$$yRestricted$$zStatID:(DE-HGF)0599
000474903 8767_ $$92023-02-14$$d2023-02-14$$eHybrid-OA$$jDEAL$$lWiley$$zBestätigungsdatum 14.2.23, Quaterly Report 01-Jan-2023 - 31-Mar-2023
000474903 8767_ $$92023$$d2023-02-14$$ePayment fee$$jDEAL$$zMPDL-Gebühr netto
000474903 909CO $$ooai:bib-pubdb1.desy.de:474903$$pdnbdelivery$$popenCost$$pVDB$$pdriver$$pOpenAPC_DEAL$$popen_access$$popenaire
000474903 9101_ $$0I:(DE-588b)2008985-5$$6P:(DE-H253)PIP1033390$$aDeutsches Elektronen-Synchrotron$$b0$$kDESY
000474903 9101_ $$0I:(DE-H253)_CFEL-20120731$$6P:(DE-H253)PIP1033390$$aCentre for Free-Electron Laser Science$$b0$$kCFEL
000474903 9101_ $$0I:(DE-588)1043621512$$6P:(DE-H253)PIP1033390$$aEuropean XFEL$$b0$$kXFEL.EU
000474903 9101_ $$0I:(DE-588b)2008985-5$$6P:(DE-H253)PIP1010779$$aDeutsches Elektronen-Synchrotron$$b1$$kDESY
000474903 9101_ $$0I:(DE-H253)_CFEL-20120731$$6P:(DE-H253)PIP1010779$$aCentre for Free-Electron Laser Science$$b1$$kCFEL
000474903 9101_ $$0I:(DE-588)1043621512$$6P:(DE-H253)PIP1010779$$aEuropean XFEL$$b1$$kXFEL.EU
000474903 9101_ $$0I:(DE-588b)2008985-5$$6P:(DE-H253)PIP1006324$$aDeutsches Elektronen-Synchrotron$$b2$$kDESY
000474903 9101_ $$0I:(DE-H253)_CFEL-20120731$$6P:(DE-H253)PIP1006324$$aCentre for Free-Electron Laser Science$$b2$$kCFEL
000474903 9101_ $$0I:(DE-588)1043621512$$6P:(DE-H253)PIP1006324$$aEuropean XFEL$$b2$$kXFEL.EU
000474903 9131_ $$0G:(DE-HGF)POF4-631$$1G:(DE-HGF)POF4-630$$2G:(DE-HGF)POF4-600$$3G:(DE-HGF)POF4$$4G:(DE-HGF)POF$$aDE-HGF$$bForschungsbereich Materie$$lVon Materie zu Materialien und Leben$$vMatter – Dynamics, Mechanisms and Control$$x0
000474903 9141_ $$y2023
000474903 915__ $$0StatID:(DE-HGF)0160$$2StatID$$aDBCoverage$$bEssential Science Indicators$$d2022-11-08
000474903 915__ $$0LIC:(DE-HGF)CCBY4$$2HGFVOC$$aCreative Commons Attribution CC BY 4.0
000474903 915__ $$0StatID:(DE-HGF)3001$$2StatID$$aDEAL Wiley$$d2022-11-08$$wger
000474903 915__ $$0StatID:(DE-HGF)0113$$2StatID$$aWoS$$bScience Citation Index Expanded$$d2022-11-08
000474903 915__ $$0StatID:(DE-HGF)0510$$2StatID$$aOpenAccess
000474903 915__ $$0StatID:(DE-HGF)0420$$2StatID$$aNationallizenz$$d2023-10-22$$wger
000474903 915__ $$0StatID:(DE-HGF)0300$$2StatID$$aDBCoverage$$bMedline$$d2023-10-22
000474903 915__ $$0StatID:(DE-HGF)0100$$2StatID$$aJCR$$bACTA CRYSTALLOGR A : 2022$$d2023-10-22
000474903 915__ $$0StatID:(DE-HGF)0200$$2StatID$$aDBCoverage$$bSCOPUS$$d2023-10-22
000474903 915__ $$0StatID:(DE-HGF)0320$$2StatID$$aDBCoverage$$bPubMed Central$$d2023-10-22
000474903 915__ $$0StatID:(DE-HGF)0600$$2StatID$$aDBCoverage$$bEbsco Academic Search$$d2023-10-22
000474903 915__ $$0StatID:(DE-HGF)0030$$2StatID$$aPeer Review$$bASC$$d2023-10-22
000474903 915__ $$0StatID:(DE-HGF)0199$$2StatID$$aDBCoverage$$bClarivate Analytics Master Journal List$$d2023-10-22
000474903 915__ $$0StatID:(DE-HGF)0150$$2StatID$$aDBCoverage$$bWeb of Science Core Collection$$d2023-10-22
000474903 915__ $$0StatID:(DE-HGF)1150$$2StatID$$aDBCoverage$$bCurrent Contents - Physical, Chemical and Earth Sciences$$d2023-10-22
000474903 915__ $$0StatID:(DE-HGF)9900$$2StatID$$aIF < 5$$d2023-10-22
000474903 915pc $$0PC:(DE-HGF)0000$$2APC$$aAPC keys set
000474903 915pc $$0PC:(DE-HGF)0001$$2APC$$aLocal Funding
000474903 915pc $$0PC:(DE-HGF)0002$$2APC$$aDFG OA Publikationskosten
000474903 915pc $$0PC:(DE-HGF)0120$$2APC$$aDEAL: Wiley 2019
000474903 9201_ $$0I:(DE-H253)FS-CFEL-1-20120731$$kFS-CFEL-1$$lCFEL-Coherent X-Ray Imaging$$x0
000474903 9201_ $$0I:(DE-H253)FS-CFEL-1-BMX-20210408$$kFS-CFEL-1-BMX$$lFS-CFEL-1 Fachgruppe BMX$$x1
000474903 9201_ $$0I:(DE-H253)UNI_CUI-20121230$$kUNI/CUI$$lbeauftragt von UNI$$x2
000474903 9201_ $$0I:(DE-H253)FS-EC-20120731$$kFS-EC$$lFS-Experiment Control$$x3
000474903 980__ $$ajournal
000474903 980__ $$aVDB
000474903 980__ $$aI:(DE-H253)FS-CFEL-1-20120731
000474903 980__ $$aI:(DE-H253)FS-CFEL-1-BMX-20210408
000474903 980__ $$aI:(DE-H253)UNI_CUI-20121230
000474903 980__ $$aI:(DE-H253)FS-EC-20120731
000474903 980__ $$aAPC
000474903 980__ $$aUNRESTRICTED
000474903 9801_ $$aAPC
000474903 9801_ $$aFullTexts