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John von Neumann - Institut für Computing; NIC

2019

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John von Neumann - Institut für Computing; NIC

2019

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Journal Article 34

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Journal Article

Partially inserted nascent chain unzips the lateral gate of the Sec translocon

Kater, Lukas
2019

EMBO reports, 20 (2019) S. e48191

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

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Journal Article

C-terminal Modulators of Heat Shock Protein of 90 kDa (HSP90): State of Development and Modes of Action

Bickel, David
2019

Bioorganic & medicinal chemistry, 27 (2019) 21, S. 115080

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

Published on 2019-08-26. Available in OpenAccess from 2021-08-26. Published on 2019-08-26. Available in OpenAccess from 2021-08-26.

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Small-molecule inhibitors of nisin resistance protein NSR from the human pathogen Streptococcus agalactiae

Porta, Nicola
2019

Bioorganic & medicinal chemistry, 27 (2019) 20, S. 115079

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

Published on 2019-08-26. Available in OpenAccess from 2021-08-26. Published on 2019-08-26. Available in OpenAccess from 2021-08-26.

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Posttranslational modification of the NADP-malic enzyme involved in C4 photosynthesis fine-tunes the enzymatic activity during the day

Bovdilova, Anastasiia
2019

The plant cell, 31 (2019) 10, S. 2525-2539

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

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Journal Article

Structural Model of the ETR1 Ethylene Receptor Transmembrane Sensor Domain

Schott-Verdugo, Stephan
2019

Scientific reports, 9 (2019) 1, S. 8869

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

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Isoform-specific Inhibition of N-methyl-D-aspartate Receptors by Bile Salts

Koch, Angela
2019

Scientific reports, 9 (2019) 1, S. 10068

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

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Journal Article

Nucleon axial, scalar, and tensor charges using lattice QCD at the physical pion mass

Hasan, Nesreen
2019

Physical Review D Physical review / D, 99 99 (2019 2019) 11 11, S. 114505 114505

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

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Novel 3,4-Dihydroisocoumarins Inhibit Human P-gp and BCRP in Multidrug Resistant Tumors and Demonstrate Substrate Inhibition of Yeast Pdr5

Sachs, Julia
2019

Frontiers in pharmacology, 10 (2019) S. 400

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

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Journal Article

JAK2 p.G571S in B-cell precursor acute lymphoblastic leukemia: a synergizing germline susceptibility

Lin, Minhui
2019

Leukemia, 33 (2019) S. 2331–2335

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

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Journal Article

Cosolvent-enhanced Sampling and Unbiased Identification of Cryptic Pockets Suitable for Structure-based Drug Design

Schmidt, Denis
2019

Journal of chemical theory and computation, 15 (2019) 5, S. 3331–3343

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

Restricted Published on 2019-04-18. Available in OpenAccess from 2020-04-18. Published on 2019-04-18. Available in OpenAccess from 2020-04-18. Restricted

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FK506 resistance of Saccharomyces cerevisiae Pdr5 and Candida albicans Cdr1 involves mutations in the transmembrane domains and extracellular loops

Tanabe, Koichi
2019

Antimicrobial agents and chemotherapy, 63 (2019) 1, S. e01146-18

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

Published on 2018-12-21. Available in OpenAccess from 2019-06-21.

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Journal Article

Converging a Knowledge-Based Scoring Function: DrugScore2018

Dittrich, Jonas
2019

Journal of chemical information and modeling, 59 (2019) 1, S. 509–521

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

Restricted Published on 2018-12-04. Available in OpenAccess from 2019-12-04. Restricted

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Journal Article

Basal Histamine H4 Receptor Activation: Agonist Mimicry by the Diphenylalanine Motif

Wifling, David
2019

Chemistry - a European journal, 25 (2019) 64, S. 14613-14624

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

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Journal Article

Higher order fluctuations and correlations of conserved charges from lattice QCD

Borsanyi, Szabolcs
2018

Journal of high energy physics, 2018 (2018) 10, S. 205

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

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Publications database 34 Open Access 24

Journal Article 34

Gohlke, Holger 26 Bonus, Michele 7 Gertzen, Christoph 4 Portillo, Israel 4 Ratti, Claudia 4 Szabo, Kalman 4 more ... Bickel, David 3 Fodor, Zoltan 3 Guenther, Jana N. 3 Pfleger, Christopher 3 Schmidt, Denis 3 Schmitt, Lutz 3 Schott-Verdugo, Stephan 3 Bauer, Petra 2 Borsanyi, Szabolcs 2 Engelhardt, Michael 2 Frieg, Benedikt 2 Hamacher, Alexandra 2 Hansen, Finn K. 2 Hasan, Nesreen 2 Kassack, Matthias U. 2 Katz, Sandor K. 2 Krieg, Stefan 2 Kurz, Thomas 2 Meinel, Stefan 2 Pasztor, Attila 2 Proksch, Peter 2 Pásztor, Attila 2 Schöler, Andrea 2 Abreu, Isabel A. 1 see all ... less ...

Computational Science and Mathematical Methods 34 Forschergruppe Gohlke 25 Physical Basis of Diseases 3 Biotechnology 2 Disinhibition and inhibition of HCN2 channel function by ligand binding to the cyclic nucleotide bin 2 Energetic and structural characterization of the activation processes of the human HCN2 ion channel 2 more ... The Proton radius and other aspects of nucleon structure from Lattice QCD 2 The QCD phase diagram and equation of state 2 Anti-infectives 1 Controlling Collective States 1 Cross-correlators of conserved charges from lattice QCD 1 Functional Macromolecules and Complexes 1 Molecular mechanisms underlying PlbF activation/deactivation via dynamic association/dissociation 1 Search for traces of the critical endpoint in QCD 1 Spin-orbital order-disorder transitions in strongly correlated systems 1 see all ... less ...

John von Neumann - Institut für Computing; NIC Jülich Supercomputing Center; JSC 34 Strukturbiochemie; ICS-6 26 Biotechnologie; IBG-1 1 Institut für Bioorganische Chemie (HHUD); IBOC 1 Institut für Molekulare Enzymtechnologie (HHUD); IMET 1 more ... JARA - HPC; JARA-HPC 1 Theoretische Nanoelektronik; IAS-3 1 see all ... less ...

2019

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