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

1

CGMD Platform: Integrated Web Servers for the Preparation, Running, and Analysis of Coarse-Grained Molecular Dynamics Simulations

Marchetto, Alessandro
2020

Molecules, 25 (2020) 24, S. 5934 -

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

2

Journal Article

Challenges in RNA Regulation in Huntington's Disease: Insights from Computational Studies

Palomino, Oscar
2020

Israel journal of chemistry, 60 (2020) 7, S. 681-693

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

3

Journal Article

Role of Tyr-39 for the Structural Features of α-Synuclein and for the Interaction with a Strong Modulator of Its Amyloid Assembly

Palomino, Oscar
2020

International journal of molecular sciences, 21 (2020) 14, S. 5061 -

“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”
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4

Journal Article

Modeling the allosteric modulation on a G-Protein Coupled Receptor: the case of M2 muscarinic Acetylcholine Receptor in complex with LY211960

Maggi, L.
2020

Scientific reports, 10 (2020) 1, S. 3037

“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”
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5

Journal Article

In silico/in vitro screening and hit evaluation identified new phenothiazine anti-prion derivatives

Zaccagnini, Ludovica
2020

European Journal of Medicinal Chemistry European journal of medicinal chemistry, 196 196 (2020 2020) S. 112295 112295

“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”
Published on 2020-04-08. Available in OpenAccess from 2022-04-08.

6

Journal Article

Impact of Cholesterol on the Stability of Monomeric and Dimeric Forms of the Translocator Protein TSPO: A Molecular Simulation Study

Si Chaib, Zeineb
2020

Molecules, 25 (2020) 18, S. 4299 -

“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”
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7

Preprint

Nintedanib Targets KIT D816V Neoplastic Cells Derived from Induced Pluripotent Stem cells of Systemic Mastocytosis

Toledo, Marcelo A. S.
2020

“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”
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8

Journal Article

Chiral Analogues of PFI-1 as BET Inhibitors and Their Functional Role in Myeloid Malignancies

Altenburg, Bianca
2020

ACS medicinal chemistry letters, 11 (2020) 10, S. 1928–1934

“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”
Published on 2020-04-02. Available in OpenAccess from 2021-04-02. Restricted Restricted

9

Journal Article

Investigating targets for neuropharmacological intervention by molecular dynamics simulations

Rossetti, Giulia
2019

Biochemical Society transactions, 47 (2019) 3, S. 909 - 918

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

10

Journal Article

RhoA regulates translation of the Nogo-A decoy SPARC in white matter-invading glioblastomas

Wirthschaft, Peter
2019

Acta neuropathologica, 138 (2019) 2, S. 275 - 293

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

11

Journal Article

High-throughput screening discovers antifibrotic properties of haloperidol by hindering myofibroblast activation

Rehman, Michael
2019

JCI insight, 4 (2019) 8, S. e123987

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

12

Journal Article

Structural Determinants of the Prion Protein N-Terminus and Its Adducts with Copper Ions

Sánchez-López, Carolina
2019

International journal of molecular sciences, 20 (2019) 1, S. 18

“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”
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13

Journal Article

Structural Prediction of the Dimeric Form of the Mammalian Translocator Membrane Protein TSPO: A Key Target for Brain Diagnostics

Zeng, Juan
2018

International journal of molecular sciences, 19 (2018) 9, S. 2588 -

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

14

Journal Article

Effect of in vivo post-translational modifications of the HMGB1 protein upon binding to platinated DNA: a molecular simulation study

Lyu, , Wenping
2018

Nucleic acids symposium series, 46 (2018) 22, S. 11687 - 11697

“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”
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15

Journal Article

The Conorfamide RPRFa Stabilizes the Open Conformation of Acid-Sensing Ion Channel 3 via the Nonproton Ligand–Sensing Domain

Reiners, Melissa
2018

Molecular pharmacology, 94 (2018) 4, S. 1114 - 1124

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

16

Journal Article

Reducing Mutant Huntingtin Protein Expression in Living Cells by a Newly Identified RNA CAG Binder

Matthes, Frank
2018

ACS chemical neuroscience, 9 (2018) 6, S. 1399 - 1408

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

17

Journal Article

Vibrational Energy in Proteins Correlates with Topology

Maggi, Luca
2018

The journal of physical chemistry letters, 9 (2018) 22, S. 6393 - 6398

“...Jülich Supercomputing Center; JSC Jülich Supercomputing Center...”
Restricted Published on 2018-10-14. Available in OpenAccess from 2019-10-14. Restricted Published on 2018-10-14. Available in OpenAccess from 2019-10-14.