http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Aguilar, M. (Corresponding author) ; Ali Cavasonza, L. ; Ambrosi, G. ; et al
Properties of Neon, Magnesium, and Silicon Primary Cosmic Rays Results from the Alpha Magnetic Spectrometer
Physical review letters 124(21), 211102 (2020) [10.1103/PhysRevLett.124.211102]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Ahmad, M. ; Luo, Y. ; Wöll, C. ; Tsotsalas, M. (Corresponding author) ; Schug, A. (Corresponding author)FZJ*
Design of Metal-Organic Framework Templated Materials Using High-Throughput Computational Screening
Molecules 25(21), 4875 - (2020) [10.3390/molecules25214875]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Altenburg, B. ; Frings, M. ; Schöbel, J.-H. ; Goßen, J. ; Pannen, K. ; Vanderliek, K. ; Rossetti, G.FZJ* ; Koschmieder, S. ; Chatain, N. ; Bolm, C. (Corresponding author)
Chiral Analogues of PFI-1 as BET Inhibitors and Their Functional Role in Myeloid Malignancies
ACS medicinal chemistry letters 11(10), 1928–1934 (2020) [10.1021/acsmedchemlett.9b00625]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Aoki, S. ; Aoki, Y. ; Bečirević, D. ; Blum, T. ; Colangelo, G. ; Collins, S. ; Della Morte, M. ; Dimopoulos, P. ; Dürr, S.FZJ* ; Fukaya, H. ; Golterman, M. ; Gottlieb, S. ; Gupta, R. ; Hashimoto, S. ; Heller, U. M. ; Herdoiza, G. ; Horsley, R. ; Jüttner, A. (Corresponding author) ; Kaneko, T. ; Lin, C. -J. D. ; Lunghi, E. ; Mawhinney, R. ; Nicholson, A. ; Onogi, T. ; Pena, C. ; Portelli, A. ; Ramos, A. ; Sharpe, S. R. ; Simone, J. N. ; Simula, S. ; Sommer, R. ; Van de Water, R. ; Vladikas, A. ; Wenger, U. ; Wittig, H.
FLAG Review 2019
The European physical journal / C 80(2), 113 (2020) [10.1140/epjc/s10052-019-7354-7]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Asante-Asamani, E. O. ; Kleefeld, A. (Corresponding author)FZJ* ; Wade, B. A.
A second-order exponential time differencing scheme for non-linear reaction-diffusion systems with dimensional splitting
Journal of computational physics 415, 109490 (2020) [10.1016/j.jcp.2020.109490]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Ayyappan Jaguva Vasudevan, A. ; Balakrishnan, K. ; Gertzen, C.FZJ* ; Borvető, F. ; Zhang, Z. ; Sangwiman, A. ; Held, U. ; Küstermann, C. ; Banerjee, S. ; Schumann, G. G. ; Häussinger, D. ; Bravo, I. G. ; Gohlke, H.FZJ* ; Münk, C. (Corresponding author)
Loop 1 of APOBEC3C regulates its antiviral activity against HIV-1
Journal of molecular biology 432(23), 6200-6227 (2020) [10.1016/j.jmb.2020.10.014]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Bachmann, C. (Corresponding author)FZJ* ; Tetzlaff, T.FZJ* ; Duarte, R.FZJ* ; Morrison, A.FZJ*
Firing rate homeostasis counteracts changes in stability of recurrent neural networks caused by synapse loss in Alzheimer’s disease
PLoS Computational Biology 16(8), e1007790 - (2020) [10.1371/journal.pcbi.1007790]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Balasubramani, S. G. ; Chen, G. P. ; Coriani, S. ; Diedenhofen, M. ; Frank, M. S. ; Franzke, Y. J. ; Furche, F. ; Grotjahn, R. ; Harding, M. E. ; Hättig, C. ; Hellweg, A. ; Helmich-Paris, B. ; Holzer, C. ; Huniar, U. ; Kaupp, M. ; Marefat Khah, A. ; Karbalaei Khani, S. ; Müller, T.FZJ* ; Mack, F. ; Nguyen, B. D. ; Parker, S. M. ; Perlt, E. ; Rappoport, D. ; Reiter, K. ; Roy, S. ; Rückert, M. ; Schmitz, G. ; Sierka, M. ; Tapavicza, E. ; Tew, D. P. ; van Wüllen, C. ; Voora, V. K. ; Weigend, F. ; Wodyński, A. ; Yu, J. M. (Corresponding author)
TURBOMOLE: Modular program suite for ab initio quantum-chemical and condensed-matter simulations
The journal of chemical physics 152(18), 184107 - (2020) [10.1063/5.0004635]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Barbarossa, M. V. (Corresponding author)Extern* ; Fuhrmann, J.FZJ* ; Meinke, J.FZJ* ; Krieg, S.FZJ* ; Varma, H. V. ; Castelletti, N. ; Lippert, T.FZJ*
Modeling the spread of COVID-19 in Germany: Early assessment and possible scenarios
PLOS ONE 15(9), e0238559 - (2020) [10.1371/journal.pone.0238559]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Berghoff, M. ; Rosenbauer, J.FZJ* ; Hoffmann, F. ; Schug, A. (Corresponding author)FZJ*
Cells in Silico – introducing a high-performance framework for large-scale tissue modeling
BMC bioinformatics 21(1), 436 (2020) [10.1186/s12859-020-03728-7]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Bonus, M. ; Sommerfeld, A. ; Qvartskhava, N. ; Görg, B. ; Ludwig, B. S. ; Kessler, H. ; Gohlke, H. (Corresponding author)FZJ* ; Häussinger, D. (Corresponding author)
Evidence for functional selectivity in TUDC- and norUDCA-induced signal transduction via α5β1 integrin towards choleresis
Scientific reports 10(1), 5795 (2020) [10.1038/s41598-020-62326-y]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Borsanyi, S. (Corresponding author) ; Fodor, Z. ; Guenther, J. N. ; Kara, R. ; Katz, S. D. ; Parotto, P. ; Pasztor, A. ; Ratti, C. ; Szabó, K. K.FZJ*
QCD Crossover at Finite Chemical Potential from Lattice Simulations
Physical review letters 125(5), 052001 (2020) [10.1103/PhysRevLett.125.052001]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Bossert, K. (Corresponding author) ; Vadas, S. L. ; Hoffmann, L.FZJ* ; Becker, E. ; Harvey, V. L. ; Bramberger, M.
Observations of Stratospheric Gravity Waves Over Europe on 12 January 2016: The Role of the Polar Night Jet
Journal of geophysical research / D 125(21), e2020JD032893 (2020) [10.1029/2020JD032893]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Bosze, B. ; Ono, Y. ; Mattes, B. ; Sinner, C. ; Gourain, V. ; Thumberger, T. ; Tlili, S. ; Wittbrodt, J. ; Saunders, T. E. ; Strähle, U. ; Schug, A.FZJ* ; Scholpp, S. (Corresponding author)
Pcdh18a regulates endocytosis of E-cadherin during axial mesoderm development in zebrafish
Histochemistry and cell biology 154(5), 463-480 (2020) [10.1007/s00418-020-01887-5]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Bouaziz, J. (Corresponding author)FZJ* ; Mendes Guimarães, F. S.FZJ* ; Lounis, S. (Corresponding author)FZJ*
A new view on the origin of zero-bias anomalies of Co atoms atop noble metal surfaces
Nature Communications 11(1), 6112 (2020) [10.1038/s41467-020-19746-1]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Bouaziz, J. (Corresponding author)FZJ* ; Ibañez-Azpiroz, J. ; Guimarães, F. S. M.FZJ* ; Lounis, S. (Corresponding author)FZJ*
Zero-point magnetic exchange interactions
Physical review research 2(4), 043357 (2020) [10.1103/PhysRevResearch.2.043357]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Breuß, M. ; Kleefeld, A. (Corresponding author)FZJ*
Implicit Monotone Difference Methods for Scalar Conservation Laws with Source Terms
Acta mathematica Vietnamica 45(3), 709–738 (2020) [10.1007/s40306-019-00354-1]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Burgeth, B. (Corresponding author) ; Kleefeld, A.FZJ* ; Naegel, B. ; Perret, B.
Editorial — Special Issue: ISMM 2019
Mathematical morphology 4(1), 159-161 (2020) [10.1515/mathm-2020-0200] special issue: "ISMM 2019"2020   Files  Fulltext Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Castagna, J. ; Guo, X. (Corresponding author) ; Seaton, M. ; O’Cais, A.FZJ*
Towards extreme scale dissipative particle dynamics simulations using multiple GPGPUs
Computer physics communications 251, 107159 - (2020) [10.1016/j.cpc.2020.107159]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Chitgar, Z. M. (Corresponding author)FZJ* ; Gibbon, P.FZJ* ; Böker, J.FZJ* ; Lehrach, A.FZJ* ; Büscher, M.FZJ*
Electron self-injection threshold for the tandem-pulse laser wakefield accelerator
Physics of plasmas 27(2), 023106 - (2020) [10.1063/1.5117503]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Cooper, O. (Corresponding author) ; Schultz, M. G.FZJ* ; Schröder, S.FZJ* ; Chang, K.-L. ; Gaudel, A. ; Benítez, G. C. ; Cuevas, E. ; Fröhlich, M. ; Galbally, I. E. ; Molloy, S. ; Kubistin, D. ; Lu, X. ; McClure-Begley, A. ; Nédélec, P. ; O’Brien, J. ; Oltmans, S. J. ; Petropavlovskikh, I. ; Ries, L. ; Senik, I. ; Sjöberg, K. ; Solberg, S. ; Spain, G. T. ; Spangl, W. ; Steinbacher, M. ; Tarasick, D. ; Thouret, V. ; Xu, X.
Multi-decadal surface ozone trends at globally distributed remote locations
Elementa 8, 23 (2020) [10.1525/elementa.420]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Costa-Surós, M. (Corresponding author)Extern* ; Sourdeval, O.Extern* ; Acquistapace, C.Extern* ; Baars, H.Extern* ; Carbajal Henken, C.Extern* ; Genz, C.Extern* ; Hesemann, J.Extern* ; Jimenez, C.Extern* ; König, M.Extern* ; Kretzschmar, J.Extern* ; Madenach, N.Extern* ; Meyer, C. I.FZJ* ; Schrödner, R.Extern* ; Seifert, P.Extern* ; Senf, F.Extern* ; Brueck, M.Extern* ; Cioni, G.Extern* ; Engels, J. F.Extern* ; Fieg, K.Extern* ; Gorges, K.Extern* ; Heinze, R.Extern* ; Siligam, P. K.Extern* ; Burkhardt, U.Extern* ; Crewell, S.Extern* ; Hoose, C.Extern* ; Seifert, A.Extern* ; Tegen, I.Extern* ; Quaas, J.Extern*
Detection and attribution of aerosol–cloud interactions in large-domain large-eddy simulations with the ICOsahedral Non-hydrostatic model
Atmospheric chemistry and physics 20(9), 5657 - 5678 (2020) [10.5194/acp-20-5657-2020]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article De Raedt, H. (Corresponding author)FZJ* ; Jattana, M. S.FZJ* ; Willsch, D.FZJ* ; Willsch, M.FZJ* ; Jin, F.FZJ* ; Michielsen, K.FZJ*
Discrete-Event Simulation of an Extended Einstein-Podolsky-Rosen-Bohm Experiment
Frontiers in physics 8, 160 (2020) [10.3389/fphy.2020.00160]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Dimura, M. ; Peulen, T.-O. ; Sanabria, H. ; Rodnin, D. ; Hemmen, K. ; Hanke, C. A. ; Seidel, C. A. M. (Corresponding author) ; Gohlke, H. (Corresponding author)FZJ*
Automated and optimally FRET-assisted structural modeling
Nature Communications 11(1), 5394 (2020) [10.1038/s41467-020-19023-1]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Dittrich, J. ; Kather, M. ; Holzberger, A. ; Pich, A. ; Gohlke, H. (Corresponding author)FZJ*
Cumulative Submillisecond All-Atom Simulations of the Temperature-Induced Coil-to-Globule Transition of Poly( N -vinylcaprolactam) in Aqueous Solution
Macromolecules 53(22), 9793–9810 (2020) [10.1021/acs.macromol.0c01896]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Dorst, A. ; Berg, R. ; Gertzen, C. G. W.FZJ* ; Schäfle, D. ; Zerbe, K. ; Gwerder, M. ; Schnell, S. D. ; Sander, P. ; Gohlke, H.FZJ* ; Gademann, K. (Corresponding author)
Semisynthetic Analogs of the Antibiotic Fidaxomicin—Design, Synthesis, and Biological Evaluation
ACS medicinal chemistry letters 11(12), 2414–2420 (2020) [10.1021/acsmedchemlett.0c00381]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Dürr, S. (Corresponding author)FZJ* ; Weber, J. H.
Dispersion relation and spectral range of Karsten-Wilczek and Borici-Creutz fermions
Physical review / D 102(1), 014516 (2020) [10.1103/PhysRevD.102.014516]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Engelhardt, M. (Corresponding author) ; Green, J. R. ; Hasan, N. ; Krieg, S.FZJ* ; Meinel, S. ; Negele, J. ; Pochinsky, A. ; Syritsyn, S.
From Ji to Jaffe-Manohar orbital angular momentum in lattice QCD using a direct derivative method
Physical review / D 102(7), 074505 (2020) [10.1103/PhysRevD.102.074505]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Frieg, B.FZJ* ; Gremer, L.FZJ* ; Heise, H.FZJ* ; Willbold, D.FZJ* ; Gohlke, H. (Corresponding author)FZJ*
Binding Modes of Thioflavin T and Congo Red to the Fibril Structure of Amyloid-β(1–42)
Chemical communications 56, 7589-7592 (2020) [10.1039/D0CC01161D]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Frieg, B.FZJ* ; Goerg, B. ; Qvartskhava, N. ; Jeitner, T. ; Homeyer, N. ; Häussinger, D. ; Gohlke, H. (Corresponding author)FZJ*
Mechanism of fully-reversible, pH-sensitive inhibition of human glutamine synthetase by tyrosine nitration
Journal of chemical theory and computation 16(7), 4694–4705 (2020) [10.1021/acs.jctc.0c00249]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Fuhrmann, J. (Corresponding author)FZJ* ; Barbarossa, M. V.
The significance of case detection ratios for predictions on the outcome of an epidemic - a message from mathematical modelers
Archives of public health 78(1), 63 (2020) [10.1186/s13690-020-00445-8]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Furtmann, F. ; Porta, N. ; Hoang, D. T. ; Reiners, J. ; Schumacher, J. ; Gottstein, J. ; Gohlke, H.FZJ* ; Smits, S. H. J. (Corresponding author)
Characterization of the nucleotide-binding domain NsrF from the BceAB-type ABC-transporter NsrFP from the human pathogen Streptococcus agalactiae
Scientific reports 10(1), 15208 (2020) [10.1038/s41598-020-72237-7]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Ghanem, K.FZJ* ; Koch, E. (Corresponding author)FZJ*
Average spectrum method for analytic continuation: Efficient blocked-mode sampling and dependence on the discretization grid
Physical review / B 101(8), 085111 (2020) [10.1103/PhysRevB.101.085111]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Ghanem, K.FZJ* ; Koch, E. (Corresponding author)FZJ*
Extending the average spectrum method: Grid point sampling and density averaging
Physical review / B 102(3), 035114 (2020) [10.1103/PhysRevB.102.035114]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Grassberger, P. (Corresponding author)FZJ*
Morphological transitions in supercritical generalized percolation and moving interfaces in media with frozen randomness
Physical review research 2(4), 043150 (2020) [10.1103/PhysRevResearch.2.043150]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Griessbach, S. (Corresponding author)FZJ* ; Hoffmann, L.FZJ* ; Spang, R.FZJ* ; Achtert, P. ; von Hobe, M.FZJ* ; Mateshvili, N. ; Müller, R.FZJ* ; Riese, M.FZJ* ; Rolf, C.FZJ* ; Seifert, P. ; Vernier, J.-P.
Aerosol and cloud top height information of Envisat MIPAS measurements
Atmospheric measurement techniques 13(3), 1243 - 1271 (2020) [10.5194/amt-13-1243-2020]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Halver, R.FZJ* ; Meinke, J. H.FZJ* ; Sutmann, G. (Corresponding author)FZJ*
Kokkos implementation of an Ewald Coulomb solver and analysis of performance portability
Journal of parallel and distributed computing 138, 48 - 54 (2020) [10.1016/j.jpdc.2019.12.003]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Harris, I. (Corresponding author) ; Kleefeld, A.FZJ*
The inverse scattering problem for a conductive boundary condition and transmission eigenvalues
Applicable analysis 99(3), 508-529 (2020) [10.1080/00036811.2018.1504028]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Heale, C. J. (Corresponding author) ; Bossert, K. ; Vadas, S. L. ; Hoffmann, L.FZJ* ; Dörnbrack, A. ; Stober, G. ; Snively, J. B. ; Jacobi, C.
Secondary Gravity Waves Generated by Breaking Mountain Waves over Europe
Journal of geophysical research / D Atmospheres D 125(5), e2019JD031662 - (2020) [10.1029/2019JD031662]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Hille, C. (Corresponding author)Extern* ; Rohe, D.FZJ* ; Honerkamp, C.RWTH* ; Andergassen, S.Extern*
Pseudogap opening in the two-dimensional Hubbard model: A functional renormalization group analysis
Physical review research 2(3), 033068 (2020) [10.1103/PhysRevResearch.2.033068]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Hindley, N. P. (Corresponding author) ; Wright, C. J. ; Hoffmann, L.FZJ* ; Moffat‐Griffin, T. ; Mitchell, N. J.
An 18‐year climatology of directional stratospheric gravity wave momentum flux from 3‐D satellite observations
Geophysical research letters 47(22), e2020GL089557 (2020) [10.1029/2020GL089557]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Huijnen, V. (Corresponding author) ; Miyazaki, K. ; Flemming, J. ; Inness, A. ; Sekiya, T. ; Schultz, M. G.FZJ*
An intercomparison of tropospheric ozone reanalysis products from CAMS, CAMS interim, TCR-1, and TCR-2
Geoscientific model development 13(3), 1513 - 1544 (2020) [10.5194/gmd-13-1513-2020]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Jattana, M. S. (Corresponding author)FZJ* ; Jin, F.FZJ* ; De Raedt, H. ; Michielsen, K.FZJ*
General error mitigation for quantum circuits
Quantum information processing 19(11), 414 (2020) [10.1007/s11128-020-02913-0]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Kalicinsky, C. (Corresponding author) ; Griessbach, S.FZJ* ; Spang, R.FZJ*
Radiative transfer simulations and observations of infrared spectra in the presence of polar stratospheric clouds: Detection and discrimination of cloud types
Atmospheric measurement techniques discussions 144, (2020) [10.5194/amt-2020-144]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Knobloch, M. (Corresponding author)FZJ* ; Mohr, B.FZJ*
Tools for GPU Computing - Debugging and Performance Analysis of Heterogenous HPC Applications
Supercomputing frontiers and innovations 7(1), 91-111 (2020) [10.14529/jsfi200105]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Kogure, M. (Corresponding author) ; Yue, J. ; Nakamura, T. ; Hoffmann, L.FZJ* ; Vadas, S. L. ; Tomikawa, Y. ; Ejiri, M. K. ; Janches, D.
First Direct Observational Evidence for Secondary Gravity Waves Generated by Mountain Waves Over the Andes
Geophysical research letters 47(17), e2020GL088845 (2020) [10.1029/2020GL088845]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Krisch, I. (Corresponding author) ; Ern, M.FZJ* ; Hoffmann, L.FZJ* ; Preusse, P.FZJ* ; Strube, C.FZJ* ; Ungermann, J.FZJ* ; Woiwode, W. ; Riese, M.FZJ*
Superposition of gravity waves with different propagation characteristics observed by airborne and space-borne infrared sounders
Atmospheric chemistry and physics / Discussions 327, - (2020) [10.5194/acp-2020-327]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Krisch, I. (Corresponding author)FZJ* ; Ern, M.FZJ* ; Hoffmann, L.FZJ* ; Preusse, P.FZJ* ; Strube, C.FZJ* ; Ungermann, J.FZJ* ; Woiwode, W. ; Riese, M.FZJ*
Superposition of gravity waves with different propagation characteristics observed by airborne and space-borne infrared sounders
Atmospheric chemistry and physics 20(19), 11469 - 11490 (2020) [10.5194/acp-20-11469-2020]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Krishnan, J. (Corresponding author) ; Torabi, R. ; Di Napoli, E.FZJ* ; Schuppert, A.
A Modified Ising Model of Barabási-Albert Network with Gene-type Spins
Journal of mathematical biology 81, 769–798 (2020) [10.1007/s00285-020-01518-6]2020   Files  Fulltext by arXiv.org Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Lelle, M. ; Otte, M. ; Bonus, M. ; Gohlke, H.FZJ* ; Benndorf, K. (Corresponding author)
Fluorophore-labeled cyclic nucleotides as potent agonists of cyclic nucleotide-regulated ion channels
ChemBioChem 21(16), 2311-2320 (2020) [10.1002/cbic.202000116]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Li, Y. ; Mohanty, S.FZJ* ; Nilsson, D. ; Hansson, B. ; Mao, K. ; Irbäck, A. (Corresponding author)
When a foreign gene meets its native counterpart: computational biophysics analysis of two PgiC loci in the grass Festuca ovina
Scientific reports 10(1), 18752 (2020) [10.1038/s41598-020-75650-0]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Liedgens, L. ; Zimmermann, J. ; Wäschenbach, L. ; Geissel, F. ; Laporte, H. ; Gohlke, H. (Corresponding author)FZJ* ; Morgan, B. (Corresponding author) ; Deponte, M. (Corresponding author)
Quantitative assessment of the determinant structural differences between redox-active and inactive glutaredoxins
Nature Communications 11(1), 1725 (2020) [10.1038/s41467-020-15441-3]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Lintermann, A. (Corresponding author)FZJ* ; Meinke, M. ; Schröder, W.
Zonal Flow Solver (ZFS): a highly efficient multi-physics simulation framework
International journal of computational fluid dynamics 34(7-8), 458-485 (2020) [10.1080/10618562.2020.1742328]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Lintermann, A. (Corresponding author)FZJ* ; Schröder, W.RWTH*
Lattice–Boltzmann simulations for complex geometries on high-performance computers
CEAS Aeronautical Journal 11, 745-766 (2020) [10.1007/s13272-020-00450-1]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Lischka, H. (Corresponding author) ; Shepard, R. ; Müller, T.FZJ* ; Szalay, P. G. ; Pitzer, R. M. ; Aquino, A. J. A. ; Araújo do Nascimento, M. M. ; Barbatti, M. ; Belcher, L. T. ; Blaudeau, J.-P. ; Borges, I. ; Brozell, S. R. ; Carter, E. A. ; Das, A. ; Gidofalvi, G. ; González, L. ; Hase, W. L. ; Kedziora, G. ; Kertesz, M. ; Kossoski, F. ; Machado, F. B. C. ; Matsika, S. ; do Monte, S. A. ; Nachtigallová, D. ; Nieman, R. ; Oppel, M. ; Parish, C. A. ; Plasser, F. ; Spada, R. F. K. ; Stahlberg, E. A. ; Ventura, E. ; Yarkony, D. R. ; Zhang, Z.
The generality of the GUGA MRCI approach in COLUMBUS for treating complex quantum chemistry
The journal of chemical physics 152(13), 134110 - (2020) [10.1063/1.5144267]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Maggi, L. (Corresponding author)FZJ* ; Carloni, P.FZJ* ; Rossetti, G.FZJ*
Modeling the allosteric modulation on a G-Protein Coupled Receptor: the case of M2 muscarinic Acetylcholine Receptor in complex with LY211960
Scientific reports 10(1), 3037 (2020) [10.1038/s41598-020-59289-5]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Marchetto, A.FZJ* ; Si Chaib, Z.FZJ* ; Rossi, C. A. ; Ribeiro, R.FZJ* ; Pantano, S. ; Rossetti, G. (Corresponding author)FZJ* ; Giorgetti, A. (Corresponding author)FZJ*
CGMD Platform: Integrated Web Servers for the Preparation, Running, and Analysis of Coarse-Grained Molecular Dynamics Simulations
Molecules 25(24), 5934 - (2020) [10.3390/molecules25245934]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Martín-Vaquero, J. (Corresponding author) ; Kleefeld, A.FZJ*
Solving nonlinear parabolic PDEs in several dimensions: Parallelized ESERK codes
Journal of computational physics 423, 109771 (2020) [10.1016/j.jcp.2020.109771]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Menzel, M. (Corresponding author)FZJ* ; Axer, M.FZJ* ; De Raedt, H. ; Costantini, I. ; Silvestri, L. ; Pavone, F. S. ; Amunts, K.FZJ* ; Michielsen, K.FZJ*
Toward a High-Resolution Reconstruction of 3D Nerve Fiber Architectures and Crossings in the Brain Using Light Scattering Measurements and Finite-Difference Time-Domain Simulations
Physical review / X 10(2), 021002 (2020) [10.1103/PhysRevX.10.021002]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Morrison, H. E. ; Lintermann, A.FZJ* ; Grundmann, S. (Corresponding author)
Hybrid datasets: Incorporating experimental data into Lattice-Boltzmann simulations
Engineering reports 2(6), e12177 (2020) [10.1002/eng2.12177]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Mulnaes, D. ; Porta, N. ; Clemens, R. ; Apanasenko, I.FZJ* ; Reiners, J. ; Gremer, L.FZJ* ; Neudecker, P.FZJ* ; Smits, S. H. J. ; Gohlke, H. (Corresponding author)FZJ*
TopModel: Template-based protein structure prediction at low sequence identity using top-down consensus and deep neural networks
Journal of chemical theory and computation 16(3), 1953-1967 (2020) [10.1021/acs.jctc.9b00825]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Nutschel, C.FZJ* ; Fulton, A. ; Zimmermann, O.FZJ* ; Schwaneberg, U. ; Jaeger, K.-E.FZJ* ; Gohlke, H. (Corresponding author)FZJ*
Systematically scrutinizing the impact of substitution sites on thermostability and detergent tolerance for Bacillus subtilis lipase A
Journal of chemical information and modeling 60(3), 1568-1584 (2020) [10.1021/acs.jcim.9b00954]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Oberleitner, L. ; Poschmann, G. ; Macorano, L. ; Schott-Verdugo, S. ; Gohlke, H.FZJ* ; Stühler, K. ; Nowack, E. C. M. (Corresponding author)
The Puzzle of Metabolite Exchange and Identification of Putative Octotrico Peptide Repeat Expression Regulators in the Nascent Photosynthetic Organelles of Paulinella chromatophora
Frontiers in microbiology 11, 607182 (2020) [10.3389/fmicb.2020.607182]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Oliveira, M. J. T. (Corresponding author) ; Papior, N. (Corresponding author) ; Pouillon, Y. (Corresponding author) ; Blum, V. ; Artacho, E. ; Caliste, D. ; Corsetti, F. ; de Gironcoli, S. ; Elena, A. M. ; García, A. ; García-Suárez, V. M. ; Genovese, L. ; Huhn, W. P. ; Huhs, G. ; Kokott, S. ; Küçükbenli, E. ; Larsen, A. H. ; Lazzaro, A. ; Lebedeva, I. V. ; Li, Y. ; López-Durán, D. ; López-Tarifa, P. ; Lüders, M. ; Marques, M. A. L. ; Minar, J. ; Mohr, S. ; Mostofi, A. A. ; O’Cais, A.FZJ* ; Payne, M. C. ; Ruh, T. ; Smith, D. G. A. ; Soler, J. M. ; Strubbe, D. A. ; Tancogne-Dejean, N. ; Tildesley, D. ; Torrent, M. ; Yu, V. W.
The CECAM electronic structure library and the modular software development paradigm
The journal of chemical physics 153(2), 024117 - (2020) [10.1063/5.0012901]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Orr, A. (Corresponding author) ; Hosking, J. S. ; Delon, A. ; Hoffmann, L.FZJ* ; Spang, R.FZJ* ; Moffat-Griffin, T. ; Keeble, J. ; Abraham, N. L. ; Braesicke, P.
Polar stratospheric clouds initiated by mountain waves in a global chemistry–climate model: a missing piece in fully modelling polar stratospheric ozone depletion
Atmospheric chemistry and physics 20(21), 12483 - 12497 (2020) [10.5194/acp-20-12483-2020]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Ostmeyer, J. (Corresponding author) ; Berkowitz, E. ; Krieg, S.FZJ* ; Lähde, T. A.FZJ* ; Luu, T.FZJ* ; Urbach, C.
Semimetal–Mott insulator quantum phase transition of the Hubbard model on the honeycomb lattice
Physical review / B 102(24), 245105 (2020) [10.1103/PhysRevB.102.245105]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Otte, P. (Corresponding author)FZJ* ; Frank, M.
A structured approach to the construction of stable linear Lattice Boltzmann collision operator
Computers and mathematics with applications 79(5), 1447-1460 (2020) [10.1016/j.camwa.2019.09.009]2020   Files  Fulltext Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Palomino, O.FZJ* ; Margreiter, M. A.FZJ* ; Rossetti, G. (Corresponding author)FZJ*
Challenges in RNA Regulation in Huntington's Disease: Insights from Computational Studies
Israel journal of chemistry 60(7), 681-693 (2020) [10.1002/ijch.202000021]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Palomino, O.FZJ* ; Buratti, F. A. ; Sacco, P. S. ; Rossetti, G.FZJ* ; Carloni, P. (Corresponding author)FZJ* ; Fernandez, C. O. (Corresponding author)
Role of Tyr-39 for the Structural Features of α-Synuclein and for the Interaction with a Strong Modulator of Its Amyloid Assembly
International journal of molecular sciences 21(14), 5061 - (2020) [10.3390/ijms21145061]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Peter, E. K.FZJ* ; Shea, J.-E. ; Schug, A. (Corresponding author)FZJ*
CORE-MD, a path correlated molecular dynamics simulation method
The journal of chemical physics 153(8), 084114 - (2020) [10.1063/5.0015398]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Pfalzner, S. (Corresponding author)FZJ* ; Vincke, K.
Cradle(s) of the Sun
The astrophysical journal / 1 897(1), 60 - (2020) [10.3847/1538-4357/ab9533]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Pfalzner, S. (Corresponding author)FZJ* ; Davies, M. B. ; Kokaia, G. ; Bannister, M. T.
Oumuamuas Passing through Molecular Clouds
The astrophysical journal / 1 903(2), 114 - (2020) [10.3847/1538-4357/abb9ae]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Pozzer, A. (Corresponding author) ; Schultz, M. G.FZJ* ; Helmig, D.
Impact of U.S. Oil and Natural Gas Emission Increases on Surface Ozone Is Most Pronounced in the Central United States
Environmental science & technology 54(19), 12423–12433 (2020) [10.1021/acs.est.9b06983]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Pucci, F. (Corresponding author)FZJ* ; Zerihun, M. B.FZJ* ; Peter, E. K.FZJ* ; Schug, A.FZJ*
Evaluating DCA-based method performances for RNA contact prediction by a well-curated data set
RNA 26(7), 794 - 802 (2020) [10.1261/rna.073809.119]2020   Files BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Qu, J. F. ; Liu, P. ; Liu, X. Y. ; Gray, R. J. ; McKenna, P.Extern* ; Li, X. (Corresponding author)FZJ* ; Kawata, S.Extern* ; Kong, Q. (Corresponding author)
Relativistic mid-wavelength infrared pulses generated in intense-laser mass-limited target interactions
New journal of physics 22(9), 093007 - (2020) [10.1088/1367-2630/abaab0]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Ratti, C. ; Bellwied, R. ; Borsanyi, S. ; Fodor, Z. ; Guenther, J. N. ; Kara, R. ; Katz, S. ; Parotto, P. ; Pasztor, A. ; Szabo, K. (Corresponding author)FZJ*
The QCD transition line from lattice simulations
Journal of physics / Conference Series 1602(1), 012011 (2020) [10.1088/1742-6596/1602/1/012011]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Reinartz, I. ; Weiel, M. ; Schug, A. (Corresponding author)FZJ*
FRET Dyes Significantly Affect SAXS Intensities of Proteins
Israel journal of chemistry 60(7), 725 - 734 (2020) [10.1002/ijch.202000007]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Rendon, G. (Corresponding author) ; Leskovec, L. ; Meinel, S. ; Negele, J. ; Paul, S. ; Petschlies, M. ; Pochinsky, A. ; Silvi, G.FZJ* ; Syritsyn, S.
I = 1 / 2 S -wave and P -wave Kπ scattering and the κ and K* resonances from lattice QCD
Physical review / D 102(11), 114520 (2020) [10.1103/PhysRevD.102.114520]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Richter, J. (Corresponding author) ; Jin, F.FZJ* ; Knipschild, L. ; De Raedt, H.Extern* ; Michielsen, K.FZJ* ; Gemmer, J. ; Steinigeweg, R.Extern*
Exponential damping induced by random and realistic perturbations
Physical review / E 101(6), 062133 (2020) [10.1103/PhysRevE.101.062133]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Rittich, H. (Corresponding author)FZJ* ; Speck, R.FZJ*
Time-parallel simulation of the Schrödinger Equation
Computer physics communications 255, 107363 - (2020) [10.1016/j.cpc.2020.107363]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Rohe, D. (Corresponding author)FZJ* ; Honerkamp , C.RWTH*
Quasi-particle functional Renormalisation Group calculations in the two-dimensional half-filled Hubbard model at finite temperatures
SciPost physics 9(6), 084 (2020) [10.21468/SciPostPhys.9.6.084]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Rosenbauer, J.FZJ* ; Zhang, C. ; Mattes, B. ; Reinartz, I. ; Wedgwood, K. ; Schindler, S. ; Sinner, C. ; Scholpp, S. (Corresponding author) ; Schug, A. (Corresponding author)FZJ*
Modeling of Wnt-mediated tissue patterning in vertebrate embryogenesis
PLoS Computational Biology 16(6), e1007417 - (2020) [10.1371/journal.pcbi.1007417]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Sanabria, H. (Corresponding author) ; Rodnin, D. ; Hemmen, K. ; Peulen, T.-O. ; Felekyan, S. ; Fleissner, M. R. ; Dimura, M. ; Koberling, F. ; Kühnemuth, R. ; Hubbell, W. ; Gohlke, H.FZJ* ; Seidel, C. A. M. (Corresponding author)
Resolving dynamics and function of transient states in single enzyme molecules
Nature Communications 11(1), 1231 (2020) [10.1038/s41467-020-14886-w]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Schepers, B. ; Gohlke, H. (Corresponding author)FZJ*
AMBER-DYES in AMBER: Implementation of fluorophore and linker parameters into AmberTools
The journal of chemical physics 152(22), 221103 (2020) [10.1063/5.0007630]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Scherzer, M. (Corresponding author) ; Seiler, E. ; Sexty, D.FZJ* ; Stamatescu, I.-O.
Controlling complex Langevin simulations of lattice models by boundary term analysis
Physical review / D 101(1), 014501 (2020) [10.1103/PhysRevD.101.014501]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Schöbel, R. (Corresponding author)FZJ* ; Speck, R.FZJ*
PFASST-ER: combining the parallel full approximation scheme in space and time with parallelization across the method
Computing and visualization in science 23(1-4), 12 (2020) [10.1007/s00791-020-00330-5]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Sedona, R. (Corresponding author)FZJ* ; Hoffmann, L.FZJ* ; Spang, R.FZJ* ; Cavallaro, G.FZJ* ; Griessbach, S.FZJ* ; Höpfner, M.Extern* ; Book, M.Extern* ; Riedel, M.FZJ*
Exploration of machine learning methods for the classification of infrared limb spectra of polar stratospheric clouds
Atmospheric measurement techniques 13(7), 3661 - 3682 (2020) [10.5194/amt-13-3661-2020]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Si Chaib, Z.FZJ* ; Marchetto, A.FZJ* ; Dishnica, K. ; Carloni, P.FZJ* ; Giorgetti, A.FZJ* ; Rossetti, G. (Corresponding author)FZJ*
Impact of Cholesterol on the Stability of Monomeric and Dimeric Forms of the Translocator Protein TSPO: A Molecular Simulation Study
Molecules 25(18), 4299 - (2020) [10.3390/molecules25184299]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Singer, S. ; Di Napoli, E. (Corresponding author)FZJ* ; Novaković, V. ; Čaklović, G.FZJ*
The LAPW Method with Eigendecomposition Based on the Hari--Zimmermann Generalized Hyperbolic SVD
SIAM journal on scientific computing 42(5), C265–C293 (2020) [10.1137/19M1277813]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Stokes, F. (Corresponding author)FZJ* ; Kamleh, W. ; Leinweber, D. B.
Elastic form factors of nucleon excitations in lattice QCD
Physical review / D 102(1), 014507 (2020) [10.1103/PhysRevD.102.014507]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Twizerimana, A. P. ; Scheck, R. ; Becker, D. ; Zhang, Z. ; Wammers, M. ; Avelar, L. ; Pflieger, M. ; Häussinger, D. ; Kurz, T. ; Gohlke, H.FZJ* ; Münk, C. (Corresponding author)
Cell type-dependent escape of capsid inhibitors by simian immunodeficiency virus SIVcpz
Journal of virology 94(23), e01338-20 (2020) [10.1128/JVI.01338-20]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Ungermann, J. (Corresponding author)FZJ* ; Bartolome, I.FZJ* ; Grießbach, S.FZJ* ; Spang, R.FZJ* ; Rolf, C.FZJ* ; Krämer, M.FZJ* ; Höpfner, M.Extern* ; Riese, M.FZJ*
Cirrus cloud shape detection by tomographic extinction retrievals from infrared limb emission sounder measurements
Atmospheric measurement techniques discussions , 2020-256 (2020) [10.5194/amt-2020-256]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Ungermann, J. (Corresponding author)FZJ* ; Bartolome, I.FZJ* ; Griessbach, S.FZJ* ; Spang, R.FZJ* ; Rolf, C.FZJ* ; Krämer, M.FZJ* ; Höpfner, M. ; Riese, M.FZJ*
Cirrus cloud shape detection by tomographic extinction retrievals from infrared limb emission sounder measurements
Atmospheric measurement techniques 13(12), 7025 - 7045 (2020) [10.5194/amt-13-7025-2020]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Verma, N. ; Dollinger, P. ; Kovacic, F.FZJ* ; Jaeger, K.-E.FZJ* ; Gohlke, H. (Corresponding author)FZJ*
The Membrane-Integrated Steric Chaperone Lif Facilitates Active Site Opening of Pseudomonas aeruginosa Lipase A
Journal of computational chemistry 4(6), 500-512 (2020) [10.1002/jcc.26085]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Viegas, A. ; Dollinger, P. ; Verma, N. ; Kubiak, J. ; Viennet, T. ; Seidel, C. A. M.Extern* ; Gohlke, H. (Corresponding author)FZJ* ; Etzkorn, M. (Corresponding author)FZJ* ; Kovacic, F.FZJ* ; Jaeger, K.-E. (Corresponding author)FZJ*
Structural and dynamic insights revealing how lipase binding domain MD1 of Pseudomonas aeruginosa foldase affects lipase activation
Scientific reports 10(1), 3578 (2020) [10.1038/s41598-020-60093-4]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Voronin, A. ; Weiel, M. ; Schug, A. (Corresponding author)FZJ*
Including residual contact information into replica-exchange MD simulations significantly enriches native-like conformations
PLOS ONE 15(11), e0242072 - (2020) [10.1371/journal.pone.0242072]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Wäschenbach, L. ; Gertzen, C. G. W.FZJ* ; Keitel, V. ; Gohlke, H. (Corresponding author)FZJ*
Dimerization energetics of the G‐protein coupled bile acid receptor TGR5 from all‐atom simulations
Journal of computational chemistry 41(9), 874-884 (2020) [10.1002/jcc.26135]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Willsch, D. (Corresponding author)FZJ* ; Willsch, M.FZJ* ; De Raedt, H. ; Michielsen, K.FZJ*
Support vector machines on the D-Wave quantum annealer
Computer physics communications 248, 107006 - (2020) [10.1016/j.cpc.2019.107006]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Willsch, M. (Corresponding author)FZJ* ; Willsch, D.FZJ* ; Jin, F.FZJ* ; De Raedt, H.FZJ* ; Michielsen, K.FZJ*
Benchmarking the quantum approximate optimization algorithm
Quantum information processing 19(7), 197 (2020) [10.1007/s11128-020-02692-8]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Willsch, M.FZJ* ; Willsch, D.FZJ* ; Michielsen, K.FZJ* ; De Raedt, H. (Corresponding author)FZJ*
Discrete-Event Simulation of Quantum Walks
Frontiers in physics 8, 145 (2020) [10.3389/fphy.2020.00145]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Willsch, M.FZJ* ; Willsch, D.FZJ* ; Michielsen, K.FZJ* ; Jin, F.FZJ* ; Denkmayr, T. ; Sponar, S. ; Hasegawa, Y. ; De Raedt, H. (Corresponding author)FZJ*
Long-Time Correlations in Single-Neutron Interferometry Data
Journal of the Physical Society of Japan 89(6), 064005 - (2020) [10.7566/JPSJ.89.064005]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Willsch, M. (Corresponding author)FZJ* ; Willsch, D.FZJ* ; Jin, F.FZJ* ; De Raedt, H. ; Michielsen, K.FZJ*
Real-time simulation of flux qubits used for quantum annealing
Physical review / A 101(1), 012327 (2020) [10.1103/PhysRevA.101.012327]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Winkelmann, M. (Corresponding author)FZJ* ; Di Napoli, E.FZJ* ; Wortmann, D.FZJ* ; Blügel, S.FZJ*
Kerker mixing scheme for self-consistent muffin-tin based all-electron electronic structure calculations
Physical review / B 102(19), 195138 (2020) [10.1103/PhysRevB.102.195138]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Xue, T. (Corresponding author) ; Li, X.Extern* ; Grassberger, P.FZJ* ; Chen, L.
Swarming transitions in hierarchical societies
Physical review research 2(4), 042017 (2020) [10.1103/PhysRevResearch.2.042017]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Zaccagnini, L. ; Rossetti, G.FZJ* ; Tran, T. H. ; Salzano, G. ; Gandini, A. ; Colini Baldeschi, A. ; Bolognesi, M. L. ; Carloni, P.FZJ* ; Legname, G. (Corresponding author)
In silico/in vitro screening and hit evaluation identified new phenothiazine anti-prion derivatives
European journal of medicinal chemistry 196, 112295 (2020) [10.1016/j.ejmech.2020.112295]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Zerihun, M. B.FZJ* ; Pucci, F.FZJ* ; Peter, E. K.FZJ* ; Schug, A. (Corresponding author)FZJ*
pydca v1.0: a comprehensive software for direct coupling analysis of RNA and protein sequences
Bioinformatics 36(7), 2264 - 2265 (2020) [10.1093/bioinformatics/btz892]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Zhang, X.-J.FZJ* ; Koch, E. (Corresponding author)FZJ* ; Pavarini, E.FZJ*
Origin of orbital ordering in YTiO 3 and LaTiO 3
Physical review / B 102(3), 035113 (2020) [10.1103/PhysRevB.102.035113]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS

http://join2-wiki.gsi.de/foswiki/pub/Main/Artwork/join2_logo100x88.png Journal Article Zou, L. (Corresponding author)FZJ* ; Griessbach, S.FZJ* ; Hoffmann, L.FZJ* ; Gong, B.FZJ* ; Wang, L.
Revisiting global satellite observations of stratospheric cirrus clouds
Atmospheric chemistry and physics 20(16), 9939 - 9959 (2020) [10.5194/acp-20-9939-2020]2020   Files  Fulltext by OpenAccess repository BibTeX | EndNote: XML, Text | RIS