JuLib | Articles & more

1

Contribution to a book

GROMEX: A Scalable and Versatile Fast Multipole Method for Biomolecular Simulation

Kohnke, Bartosz
2020

OpenAccess

2

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

Published on 2020-04-08. Available in OpenAccess from 2022-04-08.

3

Contribution to a conference proceedings

Staged deployment of interactive multi-application HPC workflows

Klijn, Wouter
2020

OpenAccess OpenAccess

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

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5

Journal Article

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

Koch, Angela
2019

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

OpenAccess OpenAccess

6

Conference Presentation

Staged deployment of interactive multi-application HPC workflows

Klijn, Wouter
2019

OpenAccess OpenAccess

7

Journal Article

Synthesis of peptoid-based class I selective histone deacetylase inhibitors with chemosensitizing properties

Krieger, Viktoria
2019

Journal of medicinal chemistry, 62 (2019) 24, S. 11260-11279

8

Contribution to a conference proceedings
Contribution to a book

Heavy-quark spin-symmetry partners of Z b (10610) and Z b (10650) molecules

Baru, V.
2019

OpenAccess OpenAccess OpenAccess OpenAccess

9

Journal Article

Converging a Knowledge-Based Scoring Function: DrugScore2018

Dittrich, Jonas
2019

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

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

10

Journal Article

Non-linear Least-Squares Optimization of Rational Filters for the Solution of Interior Hermitian Eigenvalue Problems

Winkelmann, Jan
2019

Frontiers in applied mathematics and statistics, 5 (2019) S. 5

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11

Conference Presentation

Improvement of the inside-outside duality method

Kleefeld, Andreas
2018

12

Journal Article

Role of Extracellular Loops and Membrane Lipids for Ligand Recognition in the Neuronal Adenosine Receptor Type 2A: An Enhanced Sampling Simulation Study

Cao, Ruyin
2018

Molecules, 23 (2018) 10, S. 2616 -

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13

Contribution to a book
Contribution to a conference proceedings

Sub-5-fs laser-driven nanophotonics in the relativistic intensity regime

Veisz, Laszlo
2018

14

Journal Article

Testing quantum fault tolerance on small systems

Willsch, D.
2018

Physical Review A Physical review / A, 98 98 (2018 2018) 5 5, S. 052348 052348

OpenAccess OpenAccess

15

Report

Reengineering NestML With Python And Monticore

Perun, Konstantin
2018

OpenAccess OpenAccess

16

Master Thesis

Reengineering of NestML with Python

Perun, Konstantin
2018

OpenAccess OpenAccess

17

Journal Article

Modeling Patient-Specific Magnetic Drug Targeting Within the Intracranial Vasculature

Patronis, Alexander
2018

Frontiers in physiology, 9 (2018) S. 331

OpenAccess OpenAccess

18

Journal Article

Recognition motif and mechanism of ripening inhibitory peptides in plant hormone receptor ETR1

Milić, Dalibor
2018

Scientific reports, 8 (2018) 1, S. 3890

OpenAccess OpenAccess

19

Journal Article

Critical phenomena on k -booklets

Grassberger, Peter
2017

Physical Review E Physical review / E, 95 95 (2017 2017) 1 1, S. 010102 010102

OpenAccess OpenAccess

20

Poster

ASSET for JULIA: executing massively parallel spike correlation analysis on a KNL cluster

Canova, Carlos
2017

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