JuLib | Articles & more - {"Jülich Supercomputing Center; JSC"}

1

Journal Article

The metagenome‐derived esterase PET40 is highly promiscuous and hydrolyses polyethylene terephthalate ( PET )

Zhang, Hongli
2024

The FEBS journal, 291 (2024) 1, S. 70-91

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

2

Journal Article

Resolution of Maximum Entropy Method-Derived Posterior Conformational Ensembles of a Flexible System Probed by FRET and Molecular Dynamics Simulations

Dittrich, Jonas
2023

Journal of chemical theory and computation, 19 (2023) 8, S. 2389 - 2409

“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”
Get full text Published on 2023-04-06. Available in OpenAccess from 2024-04-06.

3

Journal Article

Atomic Resolution Insights into pH Shift Induced Deprotonation Events in LS-Shaped Aβ(1–42) Amyloid Fibrils

Becker, Nina
2023

Journal of the American Chemical Society, 145 (2023) 4, S. 2161–2169

“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”
Get full text OpenAccess OpenAccess

4

Journal Article

Enzyme adaptation to habitat thermal legacy shapes the thermal plasticity of marine microbiomes

Marasco, Ramona
2023

Nature Communications, 14 (2023) 1, S. 1045

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

5

Journal Article

Combining structural and coevolution information to unveil allosteric sites

La Sala, Giuseppina
2023

Chemical science, 14 (2023) 25, S. 7057-7067

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

6

Journal Article

Loading and Co-Solvent-Triggered Release of Okanin, a C4 Plant Key Enzyme Inhibitor, into/from Functional Microgels

Dittrich, Jonas
2023

The chemical engineering journal, 460 (2023) S. 141631

“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”
Published on 2023-01-31. Available in OpenAccess from 2024-01-31.

7

Journal Article

Cumulative Millisecond-Long Sampling for a Comprehensive Energetic Evaluation of Aqueous Ionic Liquid Effects on Amino Acid Interactions

El Harrar, Till
2023

Journal of chemical information and modeling, 63 (NA) 1, S. 281–298

“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”
Get full text OpenAccess

8

Journal Article

A novel binding site in the nicotinic acetylcholine receptor for MB327 can explain its allosteric modulation relevant for organophosphorus-poisoning treatment

Kaiser, Jesko
2023

Toxicology letters, 373 (2023) S. 160-171

“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”
Published on 2022-11-26. Available in OpenAccess from 2023-11-26.

9

Journal Article

TopEnzyme: a framework and database for structural coverage of the functional enzyme space

van der Weg, Karel J
2023

Bioinformatics, 39 (2023) 3, S. btad116

“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”
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10

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

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

11

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

12

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

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

13

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 -

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

14

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

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

15

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...”
OpenAccess

16

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...”
Get full text OpenAccess OpenAccess

17

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...”

18

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...”
Get full text OpenAccess

19

Journal Article

Single MHC‐I Expression Promotes Virus‐Induced Liver Immunopathology

Xu, Haifeng C.
2022

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

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

20

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...”
OpenAccess OpenAccess

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