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John von Neumann - Institut für Computing; NIC

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Journal Article 165 Contribution to a book 35 Contribution to a conference proceedings 28 Book 6 Proceedings 5 Conference Presentation 2 Talk (non-conference) 2 more ... Dissertation / PhD Thesis 1 less ...

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Journal Article

Protein engineering for feedback resistance in 3-deoxy-D-arabino-heptulosonate 7-phosphate synthase

Jayaraman, Kumaresan
2022

Applied microbiology and biotechnology, 106 (2022) S. 6505–6517

“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”

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Journal Article

Met/Val129 polymorphism of the full-length human prion protein dictates distinct pathways of amyloid formation

Pauly, Thomas
2022

Journal of Biological Chemistry The journal of biological chemistry, 298 298 (2022 2022) 10 10, S. 102430 102430

“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”

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Contribution to a book
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Native-Contact Guided Replica Exchange Simulations of Structured RNA

Schug, Alexander
2022

“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”

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Vasor: Accurate prediction of variant effects for amino acid substitutions in multidrug resistance protein 3

Behrendt, Annika
2022

Hepatology communications, 6 (2022) 11, S. 3098-3111

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Perspectives of Quantum Computing at the Jülich Supercomputing Centre

Lippert, Thomas
2022

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Journal Article

Structural, mechanistic and physiological insights into phospholipase A-mediated membrane phospholipid degradation in Pseudomonas aeruginosa

Bleffert, Florian
2022

eLife, 11 (2022) S. e72824

“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”

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Journal Article

Respiratory and C4-photosynthetic NAD-malic enzyme coexist in bundle sheath cell mitochondria and evolved via association of differentially adapted subunits

Hüdig, Meike
2022

The plant cell, 34 (2022) 1, S. 597–615

“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”

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Journal Article

Mapping the helix arrangement of the reconstituted ETR1 ethylene receptor transmembrane domain by EPR spectroscopy

Kugele, Anandi
2022

RSC Advances, 12 (2022) S. 7352 - 7356

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Journal Article

Development of a First-in-Class Small-Molecule Inhibitor of the C-Terminal Hsp90 Dimerization

Bhatia, Sanil
2022

ACS central science, 8 (2022) 5, S. 636–655

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Journal Article

Recurrent Germline Variant in RAD21 Predisposes Children to Lymphoblastic Leukemia or Lymphoma

Schedel, Anne
2022

International journal of molecular sciences, 23 (2022) 9, S. 5174 -

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Journal Article

Rational Design Yields Molecular Insights on Leaf-Binding of Anchor Peptides

Dittrich, Jonas
2022

ACS applied materials & interfaces, 14 (2022) 25, S. 28412–28426

“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”

Published on 2022-05-23. Available in OpenAccess from 2023-05-23. Restricted

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Journal Article

Single MHC‐I Expression Promotes Virus‐Induced Liver Immunopathology

Xu, Haifeng C.
2022

Hepatology communications, 6 (2022) 7, S. 1620-1633

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Journal Article

Structure and function of redox-sensitive superfolder green fluorescent protein variant

Heimsch, Kim
2022

Antioxidants & redox signaling, 37 (2022) 1-3, S. ars.2021.0234

“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”

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Journal Article

A phospholipase B from Pseudomonas aeruginosa with activity towards endogenous phospholipids affects biofilm assembly

Weiler, Andrea J.
2022

Biochimica et biophysica acta / Molecular and cell biology of lipids, 1867 (2022) 4, S. 159101 -

“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”

Published on 2022-01-19. Available in OpenAccess from 2023-01-19.

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Contribution to a book
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TopSuite: Collection of Deep Learning-Based Metamethods to Predict and Evaluate Protein Structures and Properties

Koenig, F.
2022

“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”

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Journal Article

Functional and structural characterization of interactions between opposite subunits in HCN pacemaker channels

Kondapuram, Mahesh
2022

Communications biology, 5 (2022) 1, S. 430

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Journal Article

Unsaturated fatty acids augment protein transport via the SecA:SecYEG translocon

Kamel, Michael
2022

The FEBS journal, 289 (2022) 1, S. 140-162

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Journal Article

Time-resolved structural analysis of an RNA-cleaving DNA catalyst

Borggräfe, Jan
2022

Nature , 601 (2022) S. 144-149

“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”

Published on 2021-12-23. Available in OpenAccess from 2022-06-23. Restricted

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Journal Article

Identification and Characterization of the Haloperoxidase VPO-RR from Rhodoplanes roseus by Genome Mining and Structure-Based Catalytic Site Mapping

Porta, Nicola
2022

Catalysts, 12 (2022) 10, S. 1195 -

“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”

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Journal Article

Critical Assessment of Structure-based Approaches to Improve Protein Resistance in Aqueous Ionic Liquids by Enzyme-wide Saturation Mutagenesis

El Harrar, Till
2022

Computational and structural biotechnology journal, 20 (2022) S. 399-409

“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”

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Publications database 218 Open Access 189

Journal Article 165 Contribution to a book 35 Contribution to a conference proceedings 28 Book 6 Proceedings 5 Conference Presentation 2 more ... Talk (non-conference) 2 Dissertation / PhD Thesis 1 see all ... less ...

Gohlke, Holger 116 Schug, Alexander 18 Szabo, Kalman 18 Fodor, Z. 16 Bonus, Michele 15 Schott-Verdugo, Stephan 15 more ... Lippert, Thomas 14 Frieg, Benedikt 12 Jaeger, Karl-Erich 12 Gertzen, Christoph 11 Krieg, Stefan 11 Häussinger, Dieter 10 Katz, S. D. 10 Pfleger, Christopher 10 Lellouch, L. 9 Smits, Sander H. J. 9 Dittrich, Jonas 8 Kovacic, Filip 8 Mulnaes, Daniel 8 Pleiter, Dirk 8 Schmitt, Lutz 8 Benndorf, Klaus 7 Gertzen, Christoph G. W. 7 Groth, Georg 7 Hoelbling, C. 7 Horsley, R. 7 Nakamura, Y. 7 Schierholz, G. 7 Stüben, H. 7 Bickel, David 6 see all ... less ...

Computational Science and Mathematical Methods 126 Forschergruppe Gohlke 107 Domain-Specific Simulation & Data Life Cycle Labs (SDLs) and Research Groups 69 Biological and environmental resources for sustainable use 46 Utilization of renewable carbon and energy sources and engineering of ecosystem functions 24 Molecular Information Processing in Cellular Systems 22 more ... Scientific Computing 16 Forschergruppe Schug 10 Physical Basis of Diseases 9 Doktorand ohne besondere Förderung 7 SFB 1208: Identität und Dynamik von Membransystemen - von Molekülen bis zu zellulären Funktionen 7 Supercomputer Facility 7 Theory, modelling and simulation 7 Bioeconomy Science Center 6 Functional Macromolecules and Complexes 5 Artificial Intelligence for Air Quality 4 Biotechnology 4 Data-Intensive Science and Federated Computing 4 Deep Learning for Air Quality and Climate Forecasts 4 Earth System Data Exploration 4 Analysis of the conformational changes during activation of lipase A by its foldase 3 Biological Key Regulators and Small Chemical Compounds 3 Disinhibition and inhibition of HCN2 channel function by ligand binding to the cyclic nucleotide bin 3 Hadron physics using background fields 3 Information Processing in Neuronal Networks 3 Methoden und Systeme der Informationstechnik 3 Zentrum für strukturelle Studien 3 Antagonists of the TGR5 G-protein complex formation 2 Conformational dynamics of the unbound lipase-specific foldase Lif 2 Enabling Computational- & Data-Intensive Science and Engineering 2 see all ... less ...

John von Neumann - Institut für Computing; NIC Jülich Supercomputing Center; JSC 218 Strukturbiochemie; IBI-7 66 Bioinformatik; IBG-4 48 Strukturbiochemie; ICS-6 44 Institut für Molekulare Enzymtechnologie (HHUD); IMET 11 more ... Biotechnologie; IBG-1 7 Institut für Bioorganische Chemie (HHUD); IBOC 3 JARA - HPC; JARA-HPC 3 Zentralinstitut für Angewandte Mathematik; ZAM 3 Pflanzenwissenschaften; IBG-2 2 Theoretische Nanoelektronik; IAS-3 2 Computational Biomedicine; IAS-5 1 Computational Biomedicine; INM-9 1 Computational and Systems Neuroscience; IAS-6 1 Computational and Systems Neuroscience; INM-6 1 Elektronische Eigenschaften; PGI-6 1 Jülich-Aachen Research Alliance - Simulation Sciences; JARA-SIM 1 Quanten-Theorie der Materialien; IAS-1 1 Quanten-Theorie der Materialien; PGI-1 1 see all ... less ...

2019 34 2020 34 2021 32 2022 31 2018 20 2016 14 more ... 2017 11 2007 9 2015 9 2023 9 2008 4 2002 3 2009 3 2010 1 2024 1 see all ... less ...

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