Publications by authors named "George Sheldrick"

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Modes and model building in SHELXE.
Isabel Usón, George M Sheldrick

Acta Crystallogr D Struct Biol· January 2024

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The CCP4 suite: integrative software for macromolecular crystallography.
Jon Agirre, Mihaela Atanasova, Haroldas Bagdonas, Charles B Ballard, Arnaud Baslé, George M Sheldrick

Acta Crystallogr D Struct Biol· June 2023

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Cln5 represents a new type of cysteine-based -depalmitoylase linked to neurodegeneration.
Anna V Luebben, Daniel Bender, Stefan Becker, Lisa M Crowther, Ilka Erven, George M Sheldrick

Sci Adv· April 2022

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Non-merohedral twinning: from minerals to proteins.
Madhumati Sevvana, Michael Ruf, Isabel Usón, George M Sheldrick, Regine Herbst-Irmer

Acta Crystallogr D Struct Biol· December 2019

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: bridging the gap between small-molecule and macromolecular refinement.
Anna V Lübben, George M Sheldrick

J Appl Crystallogr· June 2019

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Aspherical scattering factors for SHELXL - model, implementation and application.
Jens Lübben, Claudia M Wandtke, Christian B Hübschle, Michael Ruf, George M Sheldrick

Acta Crystallogr A Found Adv· January 2019

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CCP4i2: the new graphical user interface to the CCP4 program suite.
Liz Potterton, Jon Agirre, Charles Ballard, Kevin Cowtan, Eleanor Dodson, George Sheldrick

Acta Crystallogr D Struct Biol· February 2018

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An introduction to experimental phasing of macromolecules illustrated by SHELX; new autotracing features.
Isabel Usón, George M Sheldrick

Acta Crystallogr D Struct Biol· February 2018

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Combining phase information in reciprocal space for molecular replacement with partial models.
Claudia Millán, Massimo Sammito, Irene Garcia-Ferrer, Theodoros Goulas, George M Sheldrick

Acta Crystallogr D Biol Crystallogr· September 2015

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Comparison of silver and molybdenum microfocus X-ray sources for single-crystal structure determination.
Lennard Krause, Regine Herbst-Irmer, George M Sheldrick, Dietmar Stalke

J Appl Crystallogr· February 2015

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SHELXT - integrated space-group and crystal-structure determination.
George M Sheldrick

Acta Crystallogr A Found Adv· January 2015

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Crystal structure refinement with SHELXL.
George M Sheldrick

Acta Crystallogr C Struct Chem· January 2015

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Ion permeation in K⁺ channels occurs by direct Coulomb knock-on.
David A Köpfer, Chen Song, Tim Gruene, George M Sheldrick, Ulrich Zachariae

Science· October 2014

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Triostin a derived cyclopeptide as architectural template for the alignment of four recognition units.
Ursula M Kotyrba, Kevin Pröpper, Eike-F Sachs, Anastasiya Myanovska, Tobias Joppe, George M Sheldrick

ChemistryOpen· August 2014

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Molecular architecture with carbohydrate functionalized β-peptides adopting 314-helical conformation.
Nitin J Pawar, Navdeep S Sidhu, George M Sheldrick, Dilip D Dhavale, Ulf Diederichsen

Beilstein J Org Chem· July 2014

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On the temperature dependence of H-U(iso) in the riding hydrogen model.
Jens Lübben, Christian Volkmann, Simon Grabowsky, Alison Edwards, Wolfgang Morgenroth, George M Sheldrick

Acta Crystallogr A Found Adv· July 2014

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Structure solution of DNA-binding proteins and complexes with ARCIMBOLDO libraries.
Kevin Pröpper, Kathrin Meindl, Massimo Sammito, Birger Dittrich, George M Sheldrick

Acta Crystallogr D Biol Crystallogr· June 2014

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Structure of sulfamidase provides insight into the molecular pathology of mucopolysaccharidosis IIIA.
Navdeep S Sidhu, Kathrin Schreiber, Kevin Pröpper, Stefan Becker, Isabel Usón, George M Sheldrick

Acta Crystallogr D Biol Crystallogr· May 2014

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Refinement of macromolecular structures against neutron data with .
Tim Gruene, Hinrich W Hahn, Anna V Luebben, Flora Meilleur, George M Sheldrick

J Appl Crystallogr· February 2014

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Validation of metal-binding sites in macromolecular structures with the CheckMyMetal web server.
Heping Zheng, Mahendra D Chordia, David R Cooper, Maksymilian Chruszcz, Peter Müller, George M Sheldrick

Nat Protoc· January 2014

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Exploiting tertiary structure through local folds for crystallographic phasing.
Massimo Sammito, Claudia Millán, Dayté D Rodríguez, Iñaki M de Ilarduya, Kathrin Meindl, George M Sheldrick

Nat Methods· November 2013

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Extending molecular-replacement solutions with SHELXE.
Andrea Thorn, George M Sheldrick

Acta Crystallogr D Biol Crystallogr· November 2013

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Structure of the parallel duplex of poly(A) RNA: evaluation of a 50 year-old prediction.
Nozhat Safaee, Anne M Noronha, Dmitry Rodionov, Guennadi Kozlov, Christopher J Wilds, George M Sheldrick

Angew Chem Int Ed Engl· September 2013

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Structure and activity of the only human RNase T2.
Andrea Thorn, Robert Steinfeld, Marc Ziegenbein, Marcel Grapp, He-Hsuan Hsiao, George M Sheldrick

Nucleic Acids Res· September 2012

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Continuous β-turn fold of an alternating alanyl/homoalanyl peptide nucleic acid.
Jose A Cuesta-Seijo, Jinhua Zhang, Ulf Diederichsen, George M Sheldrick

Acta Crystallogr D Biol Crystallogr· August 2012

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