BibTeX records: Jens Krüger 0002

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@article{DBLP:journals/ploscb/HanussekBK21,
  author       = {Maximilian Hanussek and
                  Felix Bartusch and
                  Jens Kr{\"{u}}ger},
  title        = {Performance and scaling behavior of bioinformatic applications in
                  virtualization environments to create awareness for the efficient
                  use of compute resources},
  journal      = {PLoS Comput. Biol.},
  volume       = {17},
  number       = {7},
  year         = {2021},
  url          = {https://doi.org/10.1371/journal.pcbi.1009244},
  doi          = {10.1371/JOURNAL.PCBI.1009244},
  timestamp    = {Sun, 02 Oct 2022 01:00:00 +0200},
  biburl       = {https://dblp.org/rec/journals/ploscb/HanussekBK21.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/fgcs/HanussekBK20,
  author       = {Maximilian Hanussek and
                  Felix Bartusch and
                  Jens Kr{\"{u}}ger},
  title        = {{BOOTABLE:} Bioinformatics benchmark tool suite for applications and
                  hardware},
  journal      = {Future Gener. Comput. Syst.},
  volume       = {102},
  pages        = {1016--1026},
  year         = {2020},
  url          = {https://doi.org/10.1016/j.future.2019.09.057},
  doi          = {10.1016/J.FUTURE.2019.09.057},
  timestamp    = {Mon, 05 Feb 2024 00:00:00 +0100},
  biburl       = {https://dblp.org/rec/journals/fgcs/HanussekBK20.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@inproceedings{DBLP:conf/molva-ws/GiuliariKZDHRKG20,
  author       = {Beatrice Giuliari and
                  Manuel K{\"{o}}sters and
                  Jan Zhou and
                  Tim Dingersen and
                  Andr{\'{e}} J. Heissmann and
                  Ralf Rotzoll and
                  Jens Kr{\"{u}}ger and
                  Alejandro Giorgetti and
                  Bj{\"{o}}rn Sommer},
  editor       = {Jan Byska and
                  Michael Krone and
                  Bj{\"{o}}rn Sommer},
  title        = {The Vesicle Builder - {A} Membrane Packing Algorithm for the CELLmicrocosmos
                  MembraneEditor},
  booktitle    = {3rd Workshop on Molecular Graphics and Visual Analysis of Molecular
                  Data, MolVA@Eurographics/EuroVis 2020, Norrk{\"{o}}ping, Sweden,
                  May 25, 2020 [online only]},
  pages        = {7--15},
  publisher    = {Eurographics Association},
  year         = {2020},
  url          = {https://doi.org/10.2312/molva.20201096},
  doi          = {10.2312/MOLVA.20201096},
  timestamp    = {Wed, 08 Dec 2021 09:19:09 +0100},
  biburl       = {https://dblp.org/rec/conf/molva-ws/GiuliariKZDHRKG20.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@inproceedings{DBLP:conf/ccgrid/HanussekB0K19,
  author       = {Maximilian Hanussek and
                  Felix Bartusch and
                  Jens Kr{\"{u}}ger and
                  Oliver Kohlbacher},
  title        = {{BOOTABLE:} Bioinformatics Benchmark Tool Suite},
  booktitle    = {19th {IEEE/ACM} International Symposium on Cluster, Cloud and Grid
                  Computing, {CCGRID} 2019, Larnaca, Cyprus, May 14-17, 2019},
  pages        = {157--160},
  publisher    = {{IEEE}},
  year         = {2019},
  url          = {https://doi.org/10.1109/CCGRID.2019.00027},
  doi          = {10.1109/CCGRID.2019.00027},
  timestamp    = {Mon, 05 Feb 2024 00:00:00 +0100},
  biburl       = {https://dblp.org/rec/conf/ccgrid/HanussekB0K19.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@inproceedings{DBLP:conf/ccgrid/BartuschH0K19,
  author       = {Felix Bartusch and
                  Maximilian Hanussek and
                  Jens Kr{\"{u}}ger and
                  Oliver Kohlbacher},
  title        = {Reproducible Scientific Workflows for High Performance and Cloud Computing},
  booktitle    = {19th {IEEE/ACM} International Symposium on Cluster, Cloud and Grid
                  Computing, {CCGRID} 2019, Larnaca, Cyprus, May 14-17, 2019},
  pages        = {161--164},
  publisher    = {{IEEE}},
  year         = {2019},
  url          = {https://doi.org/10.1109/CCGRID.2019.00028},
  doi          = {10.1109/CCGRID.2019.00028},
  timestamp    = {Mon, 05 Feb 2024 00:00:00 +0100},
  biburl       = {https://dblp.org/rec/conf/ccgrid/BartuschH0K19.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/f1000research/BelmannFKPRPHLBGKPS19,
  author       = {Peter Belmann and
                  Bj{\"{o}}rn Fischer and
                  Jan Kr{\"{u}}ger and
                  Michal Proch{\'{a}}zka and
                  Helena Rasche and
                  Manuel Prinz and
                  Maximilian Hanussek and
                  Martin Lang and
                  Felix Bartusch and
                  Benjamin Gl{\"{a}}{\ss}le and
                  Jens Kr{\"{u}}ger and
                  Alfred P{\"{u}}hler and
                  Alexander Sczyrba},
  title        = {de.NBI Cloud federation through {ELIXIR} {AAI}},
  journal      = {F1000Research},
  volume       = {8},
  pages        = {842},
  year         = {2019},
  url          = {https://doi.org/10.12688/f1000research.19013.1},
  doi          = {10.12688/F1000RESEARCH.19013.1},
  timestamp    = {Mon, 28 Aug 2023 01:00:00 +0200},
  biburl       = {https://dblp.org/rec/journals/f1000research/BelmannFKPRPHLBGKPS19.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/fgcs/GesingDPKGHH18,
  author       = {Sandra Gesing and
                  Rion Dooley and
                  Marlon E. Pierce and
                  Jens Kr{\"{u}}ger and
                  Richard Grunzke and
                  Sonja Herres{-}Pawlis and
                  Alexander Hoffmann},
  title        = {Gathering requirements for advancing simulations in {HPC} infrastructures
                  via science gateways},
  journal      = {Future Gener. Comput. Syst.},
  volume       = {82},
  pages        = {544--554},
  year         = {2018},
  url          = {https://doi.org/10.1016/j.future.2017.02.042},
  doi          = {10.1016/J.FUTURE.2017.02.042},
  timestamp    = {Wed, 19 Feb 2020 00:00:00 +0100},
  biburl       = {https://dblp.org/rec/journals/fgcs/GesingDPKGHH18.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@inproceedings{DBLP:conf/iwsg/BartuschHK18,
  author       = {Felix Bartusch and
                  Maximilian Hanussek and
                  Jens Kr{\"{u}}ger},
  editor       = {Malcolm P. Atkinson and
                  Sandra Gesing},
  title        = {Automatic Generation of Provenance Metadata during Execution of Scientific
                  Workflows},
  booktitle    = {Proceedings of the 10th International Workshop on Science Gateways,
                  Edinburgh, Scotland, UK, 13-15 June, 2018},
  series       = {{CEUR} Workshop Proceedings},
  volume       = {2357},
  publisher    = {CEUR-WS.org},
  year         = {2018},
  url          = {https://ceur-ws.org/Vol-2357/paper8.pdf},
  timestamp    = {Fri, 10 Mar 2023 16:23:48 +0100},
  biburl       = {https://dblp.org/rec/conf/iwsg/BartuschHK18.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/grid/GrunzkeKJNHH17,
  author       = {Richard Grunzke and
                  Jens Kr{\"{u}}ger and
                  Ren{\'{e}} J{\"{a}}kel and
                  Wolfgang E. Nagel and
                  Sonja Herres{-}Pawlis and
                  Alexander Hoffmann},
  title        = {Metadata Management in the MoSGrid Science Gateway - Evaluation and
                  the Expansion of Quantum Chemistry Support},
  journal      = {J. Grid Comput.},
  volume       = {15},
  number       = {1},
  pages        = {41--53},
  year         = {2017},
  url          = {https://doi.org/10.1007/s10723-016-9362-2},
  doi          = {10.1007/S10723-016-9362-2},
  timestamp    = {Thu, 14 Oct 2021 01:00:00 +0200},
  biburl       = {https://dblp.org/rec/journals/grid/GrunzkeKJNHH17.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@inproceedings{DBLP:conf/hicss/ZimmermannG017,
  author       = {Lukas Zimmermann and
                  Richard Grunzke and
                  Jens Kr{\"{u}}ger},
  editor       = {Tung Bui},
  title        = {Maintaining a Science Gateway - Lessons Learned from MoSGrid},
  booktitle    = {50th Hawaii International Conference on System Sciences, {HICSS} 2017,
                  Hilton Waikoloa Village, Hawaii, USA, January 4-7, 2017},
  pages        = {1--10},
  publisher    = {ScholarSpace / {AIS} Electronic Library (AISeL)},
  year         = {2017},
  url          = {https://hdl.handle.net/10125/41918},
  timestamp    = {Wed, 04 May 2022 01:00:00 +0200},
  biburl       = {https://dblp.org/rec/conf/hicss/ZimmermannG017.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@inproceedings{DBLP:conf/iccsa/LaganaTK17,
  author       = {Antonio Lagan{\`{a}} and
                  G{\'{a}}bor Tersty{\'{a}}nszky and
                  Jens Kr{\"{u}}ger},
  editor       = {Osvaldo Gervasi and
                  Beniamino Murgante and
                  Sanjay Misra and
                  Giuseppe Borruso and
                  Carmelo Maria Torre and
                  Ana Maria A. C. Rocha and
                  David Taniar and
                  Bernady O. Apduhan and
                  Elena N. Stankova and
                  Alfredo Cuzzocrea},
  title        = {Open Molecular Science for the Open Science Cloud},
  booktitle    = {Computational Science and Its Applications - {ICCSA} 2017 - 17th International
                  Conference, Trieste, Italy, July 3-6, 2017, Proceedings, Part {III}},
  series       = {Lecture Notes in Computer Science},
  volume       = {10406},
  pages        = {29--43},
  publisher    = {Springer},
  year         = {2017},
  url          = {https://doi.org/10.1007/978-3-319-62398-6\_3},
  doi          = {10.1007/978-3-319-62398-6\_3},
  timestamp    = {Tue, 14 May 2019 10:00:43 +0200},
  biburl       = {https://dblp.org/rec/conf/iccsa/LaganaTK17.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@inproceedings{DBLP:conf/iwsg/HanussekB0K17,
  author       = {Maximilian Hanussek and
                  Felix Bartusch and
                  Jens Kr{\"{u}}ger and
                  Oliver Kohlbacher},
  editor       = {Sandra Gesing and
                  Krzysztof Kurowski and
                  Tam{\'{a}}s Kiss},
  title        = {Efficient Mass Spectra Prediction through Container Orchestration
                  with a Scientific Workflow},
  booktitle    = {Proceedings of the 9th International Workshop on Science Gateways,
                  Pozna{\'{n}}, Poland, 19-21 June, 2017},
  series       = {{CEUR} Workshop Proceedings},
  volume       = {2363},
  publisher    = {CEUR-WS.org},
  year         = {2017},
  url          = {https://ceur-ws.org/Vol-2363/paper6.pdf},
  timestamp    = {Fri, 10 Mar 2023 16:23:48 +0100},
  biburl       = {https://dblp.org/rec/conf/iwsg/HanussekB0K17.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@proceedings{DBLP:conf/iwsg/2016,
  editor       = {Sandra Gesing and
                  Jens Kr{\"{u}}ger},
  title        = {Proceedings of the 8th International Workshop on Science Gateways,
                  {IWSG} 2016, Rome, Italy, June 8-10, 2016},
  series       = {{CEUR} Workshop Proceedings},
  volume       = {1871},
  publisher    = {CEUR-WS.org},
  year         = {2017},
  url          = {https://ceur-ws.org/Vol-1871},
  urn          = {urn:nbn:de:0074-1871-4},
  timestamp    = {Fri, 10 Mar 2023 00:00:00 +0100},
  biburl       = {https://dblp.org/rec/conf/iwsg/2016.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/grid/GesingKGHH16,
  author       = {Sandra Gesing and
                  Jens Kr{\"{u}}ger and
                  Richard Grunzke and
                  Sonja Herres{-}Pawlis and
                  Alexander Hoffmann},
  title        = {Using Science Gateways for Bridging the Differences between Research
                  Infrastructures},
  journal      = {J. Grid Comput.},
  volume       = {14},
  number       = {4},
  pages        = {545--557},
  year         = {2016},
  url          = {https://doi.org/10.1007/s10723-016-9385-8},
  doi          = {10.1007/S10723-016-9385-8},
  timestamp    = {Mon, 16 Sep 2019 01:00:00 +0200},
  biburl       = {https://dblp.org/rec/journals/grid/GesingKGHH16.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcheminf/ArshadHGGKKHT16,
  author       = {Junaid Arshad and
                  Alexander Hoffmann and
                  Sandra Gesing and
                  Richard Grunzke and
                  Jens Kr{\"{u}}ger and
                  Tam{\'{a}}s Kiss and
                  Sonja Herres{-}Pawlis and
                  G{\'{a}}bor Tersty{\'{a}}nszky},
  title        = {Multi-level meta-workflows: new concept for regularly occurring tasks
                  in quantum chemistry},
  journal      = {J. Cheminformatics},
  volume       = {8},
  number       = {1},
  pages        = {58:1--58:17},
  year         = {2016},
  url          = {https://doi.org/10.1186/s13321-016-0169-8},
  doi          = {10.1186/S13321-016-0169-8},
  timestamp    = {Sun, 25 Jul 2021 01:00:00 +0200},
  biburl       = {https://dblp.org/rec/journals/jcheminf/ArshadHGGKKHT16.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/peerjpre/KrugerK16,
  author       = {Jens Kr{\"{u}}ger and
                  Oliver Kohlbacher},
  title        = {Containerization and wrapping of a mass spectra prediction workflow},
  journal      = {PeerJ Prepr.},
  volume       = {4},
  pages        = {e2528},
  year         = {2016},
  url          = {https://doi.org/10.7287/peerj.preprints.2528v1},
  doi          = {10.7287/PEERJ.PREPRINTS.2528V1},
  timestamp    = {Thu, 09 Jul 2020 01:00:00 +0200},
  biburl       = {https://dblp.org/rec/journals/peerjpre/KrugerK16.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/bioinformatics/HildebrandtSFG0NRSSTLKH15,
  author       = {Anna Katharina Hildebrandt and
                  Daniel St{\"{o}}ckel and
                  Nina M. Fischer and
                  Luis de la Garza and
                  Jens Kr{\"{u}}ger and
                  Stefan Nickels and
                  Marc R{\"{o}}ttig and
                  Charlotta Sch{\"{a}}rfe and
                  Marcel Schumann and
                  Philipp Thiel and
                  Hans{-}Peter Lenhof and
                  Oliver Kohlbacher and
                  Andreas Hildebrandt},
  title        = {ballaxy: web services for structural bioinformatics},
  journal      = {Bioinform.},
  volume       = {31},
  number       = {1},
  pages        = {121--122},
  year         = {2015},
  url          = {https://doi.org/10.1093/bioinformatics/btu574},
  doi          = {10.1093/BIOINFORMATICS/BTU574},
  timestamp    = {Mon, 02 Mar 2020 00:00:00 +0100},
  biburl       = {https://dblp.org/rec/journals/bioinformatics/HildebrandtSFG0NRSSTLKH15.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/concurrency/Herres-PawlisHBKBBG0GGTW15,
  author       = {Sonja Herres{-}Pawlis and
                  Alexander Hoffmann and
                  {\'{A}}kos Balask{\'{o}} and
                  P{\'{e}}ter Kacsuk and
                  Georg Birkenheuer and
                  Andr{\'{e}} Brinkmann and
                  Luis de la Garza and
                  Jens Kr{\"{u}}ger and
                  Sandra Gesing and
                  Richard Grunzke and
                  G{\'{a}}bor Tersty{\'{a}}nszky and
                  Noam Weingarten},
  title        = {Quantum chemical meta-workflows in MoSGrid},
  journal      = {Concurr. Comput. Pract. Exp.},
  volume       = {27},
  number       = {2},
  pages        = {344--357},
  year         = {2015},
  url          = {https://doi.org/10.1002/cpe.3292},
  doi          = {10.1002/CPE.3292},
  timestamp    = {Mon, 02 Mar 2020 00:00:00 +0100},
  biburl       = {https://dblp.org/rec/journals/concurrency/Herres-PawlisHBKBBG0GGTW15.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@inproceedings{DBLP:conf/eScience/GrunzkeAN0HHG15,
  author       = {Richard Grunzke and
                  Alvaro Aguilera and
                  Wolfgang E. Nagel and
                  Jens Kr{\"{u}}ger and
                  Sonja Herres{-}Pawlis and
                  Alexander Hoffmann and
                  Sandra Gesing},
  title        = {Managing Complexity in Distributed Data Life Cycles Enhancing Scientific
                  Discovery},
  booktitle    = {11th {IEEE} International Conference on e-Science, e-Science 2015,
                  Munich, Germany, August 31 - September 4, 2015},
  pages        = {371--380},
  publisher    = {{IEEE} Computer Society},
  year         = {2015},
  url          = {https://doi.org/10.1109/eScience.2015.72},
  doi          = {10.1109/ESCIENCE.2015.72},
  timestamp    = {Fri, 24 Mar 2023 00:00:00 +0100},
  biburl       = {https://dblp.org/rec/conf/eScience/GrunzkeAN0HHG15.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@inproceedings{DBLP:conf/ieeehpcs/GesingDP0GHH15,
  author       = {Sandra Gesing and
                  Rion Dooley and
                  Marlon E. Pierce and
                  Jens Kr{\"{u}}ger and
                  Richard Grunzke and
                  Sonja Herres{-}Pawlis and
                  Alexander Hoffmann},
  title        = {Science gateways - leveraging modeling and simulations in {HPC} infrastructures
                  via increased usability},
  booktitle    = {2015 International Conference on High Performance Computing {\&}
                  Simulation, {HPCS} 2015, Amsterdam, Netherlands, July 20-24, 2015},
  pages        = {19--26},
  publisher    = {{IEEE}},
  year         = {2015},
  url          = {https://doi.org/10.1109/HPCSim.2015.7237017},
  doi          = {10.1109/HPCSIM.2015.7237017},
  timestamp    = {Wed, 16 Oct 2019 14:14:54 +0200},
  biburl       = {https://dblp.org/rec/conf/ieeehpcs/GesingDP0GHH15.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/concurrency/GrunzkeBGHKBGPSSSSSMJNA014,
  author       = {Richard Grunzke and
                  Sebastian Breuers and
                  Sandra Gesing and
                  Sonja Herres{-}Pawlis and
                  Martin Kruse and
                  Dirk Blunk and
                  Luis de la Garza and
                  Lars Packschies and
                  Patrick Sch{\"{a}}fer and
                  Charlotta Sch{\"{a}}rfe and
                  Tobias Schlemmer and
                  Thomas Steinke and
                  Bernd Schuller and
                  Ralph M{\"{u}}ller{-}Pfefferkorn and
                  Ren{\'{e}} J{\"{a}}kel and
                  Wolfgang E. Nagel and
                  Malcolm P. Atkinson and
                  Jens Kr{\"{u}}ger},
  title        = {Standards-based metadata management for molecular simulations},
  journal      = {Concurr. Comput. Pract. Exp.},
  volume       = {26},
  number       = {10},
  pages        = {1744--1759},
  year         = {2014},
  url          = {https://doi.org/10.1002/cpe.3116},
  doi          = {10.1002/CPE.3116},
  timestamp    = {Wed, 11 May 2022 01:00:00 +0200},
  biburl       = {https://dblp.org/rec/journals/concurrency/GrunzkeBGHKBGPSSSSSMJNA014.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcheminf/LukatS014,
  author       = {Gunther Lukat and
                  Bj{\"{o}}rn Sommer and
                  Jens Kr{\"{u}}ger},
  title        = {Membrane simulation analysis using Voronoi tessellation},
  journal      = {J. Cheminformatics},
  volume       = {6},
  number       = {{S-1}},
  pages        = {23},
  year         = {2014},
  url          = {https://doi.org/10.1186/1758-2946-6-S1-O23},
  doi          = {10.1186/1758-2946-6-S1-O23},
  timestamp    = {Wed, 08 Dec 2021 00:00:00 +0100},
  biburl       = {https://dblp.org/rec/journals/jcheminf/LukatS014.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@inproceedings{DBLP:conf/iwsg/Herres-PawlisHG0G14,
  author       = {Sonja Herres{-}Pawlis and
                  Alexander Hoffmann and
                  Luis de la Garza and
                  Jens Kr{\"{u}}ger and
                  Richard Grunzke},
  title        = {Expansion of Quantum Chemical Metadata for Workflows in the MoSGrid
                  Science Gateway},
  booktitle    = {6th International Workshop on Science Gateways, {IWSG} 2014, Dublin,
                  Ireland, June 3-5, 2014},
  pages        = {67--72},
  publisher    = {{IEEE} Computer Society},
  year         = {2014},
  url          = {https://doi.org/10.1109/IWSG.2014.18},
  doi          = {10.1109/IWSG.2014.18},
  timestamp    = {Fri, 24 Mar 2023 00:00:00 +0100},
  biburl       = {https://dblp.org/rec/conf/iwsg/Herres-PawlisHG0G14.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@inproceedings{DBLP:conf/iwsg/Herres-PawlisHG0GGNTW14,
  author       = {Sonja Herres{-}Pawlis and
                  Alexander Hoffmann and
                  Luis de la Garza and
                  Jens Kr{\"{u}}ger and
                  Sandra Gesing and
                  Richard Grunzke and
                  Wolfgang E. Nagel and
                  G{\'{a}}bor Tersty{\'{a}}nszky and
                  Noam Weingarten},
  title        = {Meta-Metaworkflows for Combining Quantum Chemistry and Molecular Dynamics
                  in the MoSGrid Science Gateway},
  booktitle    = {6th International Workshop on Science Gateways, {IWSG} 2014, Dublin,
                  Ireland, June 3-5, 2014},
  pages        = {73--78},
  publisher    = {{IEEE} Computer Society},
  year         = {2014},
  url          = {https://doi.org/10.1109/IWSG.2014.20},
  doi          = {10.1109/IWSG.2014.20},
  timestamp    = {Fri, 24 Mar 2023 00:00:00 +0100},
  biburl       = {https://dblp.org/rec/conf/iwsg/Herres-PawlisHG0GGNTW14.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@inproceedings{DBLP:conf/iwsg/Bozic0SLSK14,
  author       = {Stefan Bozic and
                  Jens Kr{\"{u}}ger and
                  Claude Sinner and
                  Benjamin Lutz and
                  Alexander Schug and
                  Ivan Kondov},
  title        = {Integration of eSBMTools into the MoSGrid Portal Using the gUSE Technology},
  booktitle    = {6th International Workshop on Science Gateways, {IWSG} 2014, Dublin,
                  Ireland, June 3-5, 2014},
  pages        = {85--90},
  publisher    = {{IEEE} Computer Society},
  year         = {2014},
  url          = {https://doi.org/10.1109/IWSG.2014.21},
  doi          = {10.1109/IWSG.2014.21},
  timestamp    = {Fri, 24 Mar 2023 00:00:00 +0100},
  biburl       = {https://dblp.org/rec/conf/iwsg/Bozic0SLSK14.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@incollection{DBLP:books/sp/14/Gesing0GGHH14,
  author       = {Sandra Gesing and
                  Jens Kr{\"{u}}ger and
                  Richard Grunzke and
                  Luis de la Garza and
                  Sonja Herres{-}Pawlis and
                  Alexander Hoffmann},
  editor       = {P{\'{e}}ter Kacsuk},
  title        = {Molecular Simulation Grid (MosGrid): {A} Science Gateway Tailored
                  to the Molecular Simulation Community},
  booktitle    = {Science Gateways for Distributed Computing Infrastructures, Development
                  Framework and Exploitation by Scientific User Communities},
  pages        = {151--165},
  publisher    = {Springer},
  year         = {2014},
  url          = {https://doi.org/10.1007/978-3-319-11268-8\_11},
  doi          = {10.1007/978-3-319-11268-8\_11},
  timestamp    = {Tue, 16 May 2017 14:01:43 +0200},
  biburl       = {https://dblp.org/rec/books/sp/14/Gesing0GGHH14.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@incollection{DBLP:books/sp/14/OlabarriagaBCJ0GMSDK14,
  author       = {S{\'{\i}}lvia Delgado Olabarriaga and
                  Ammar Benabdelkader and
                  Matthan W. A. Caan and
                  Mohammad Mahdi Jaghoori and
                  Jens Kr{\"{u}}ger and
                  Luis de la Garza and
                  Christopher Mohr and
                  Benjamin Schubert and
                  Anatoli Danezi and
                  Tam{\'{a}}s Kiss},
  editor       = {P{\'{e}}ter Kacsuk},
  title        = {WS-PGRADE/gUSE-Based Science Gateways in Teaching},
  booktitle    = {Science Gateways for Distributed Computing Infrastructures, Development
                  Framework and Exploitation by Scientific User Communities},
  pages        = {223--234},
  publisher    = {Springer},
  year         = {2014},
  url          = {https://doi.org/10.1007/978-3-319-11268-8\_16},
  doi          = {10.1007/978-3-319-11268-8\_16},
  timestamp    = {Thu, 14 Oct 2021 01:00:00 +0200},
  biburl       = {https://dblp.org/rec/books/sp/14/OlabarriagaBCJ0GMSDK14.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcheminf/PackschiesBBBBVFGGHK0KLMSSSWZ13,
  author       = {Lars Packschies and
                  Georg Birkenheuer and
                  Dirk Blunk and
                  Sebastian Breuers and
                  Andr{\'{e}} Brinkmann and
                  Ines dos Santos Vieira and
                  Gregor Fels and
                  Sandra Gesing and
                  Richard Grunzke and
                  Sonja Herres{-}Pawlis and
                  Oliver Kohlbacher and
                  Jens Kr{\"{u}}ger and
                  Martin Kruse and
                  Ulrich Lang and
                  Ralph M{\"{u}}ller{-}Pfefferkorn and
                  Patrick Sch{\"{a}}fer and
                  Tobias Schlemmer and
                  Thomas Steinke and
                  Klaus{-}Dieter Warzecha and
                  Andreas Zink},
  title        = {The MoSGrid - e-science gateway: molecular simulations in a distributed
                  computing environment},
  journal      = {J. Cheminformatics},
  volume       = {5},
  number       = {{S-1}},
  pages        = {3},
  year         = {2013},
  url          = {https://doi.org/10.1186/1758-2946-5-S1-O3},
  doi          = {10.1186/1758-2946-5-S1-O3},
  timestamp    = {Mon, 11 Jul 2022 01:00:00 +0200},
  biburl       = {https://dblp.org/rec/journals/jcheminf/PackschiesBBBBVFGGHK0KLMSSSWZ13.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcheminf/ScharfeTRF0WK13,
  author       = {Charlotta Sch{\"{a}}rfe and
                  Joachim Taeger and
                  Peggy Reuter and
                  Nina M. Fischer and
                  Jens Kr{\"{u}}ger and
                  Bernd Wissinger and
                  Oliver Kohlbacher},
  title        = {Development of a pharmacorphore model for pharmacological chaperones
                  targeting mutant trafficking-deficient {CNG} channels},
  journal      = {J. Cheminformatics},
  volume       = {5},
  number       = {{S-1}},
  pages        = {18},
  year         = {2013},
  url          = {https://doi.org/10.1186/1758-2946-5-S1-O18},
  doi          = {10.1186/1758-2946-5-S1-O18},
  timestamp    = {Sun, 02 Jun 2019 01:00:00 +0200},
  biburl       = {https://dblp.org/rec/journals/jcheminf/ScharfeTRF0WK13.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcisd/Lukat0S13,
  author       = {Gunther Lukat and
                  Jens Kr{\"{u}}ger and
                  Bj{\"{o}}rn Sommer},
  title        = {APL@Voro: {A} Voronoi-Based Membrane Analysis Tool for {GROMACS} Trajectories},
  journal      = {J. Chem. Inf. Model.},
  volume       = {53},
  number       = {11},
  pages        = {2908--2925},
  year         = {2013},
  url          = {https://doi.org/10.1021/ci400172g},
  doi          = {10.1021/CI400172G},
  timestamp    = {Wed, 08 Dec 2021 00:00:00 +0100},
  biburl       = {https://dblp.org/rec/journals/jcisd/Lukat0S13.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@inproceedings{DBLP:conf/cluster/Herres-PawlisHGG0G13,
  author       = {Sonja Herres{-}Pawlis and
                  Alexander Hoffmann and
                  Sandra Gesing and
                  Luis de la Garza and
                  Jens Kr{\"{u}}ger and
                  Richard Grunzke},
  title        = {User-friendly metaworkflows in quantum chemistry},
  booktitle    = {2013 {IEEE} International Conference on Cluster Computing, {CLUSTER}
                  2013, Indianapolis, IN, USA, September 23-27, 2013},
  pages        = {1--3},
  publisher    = {{IEEE} Computer Society},
  year         = {2013},
  url          = {https://doi.org/10.1109/CLUSTER.2013.6702700},
  doi          = {10.1109/CLUSTER.2013.6702700},
  timestamp    = {Thu, 23 Mar 2023 00:00:00 +0100},
  biburl       = {https://dblp.org/rec/conf/cluster/Herres-PawlisHGG0G13.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@inproceedings{DBLP:conf/iwsg/Garza0SRARK13,
  author       = {Luis de la Garza and
                  Jens Kr{\"{u}}ger and
                  Charlotta Sch{\"{a}}rfe and
                  Marc R{\"{o}}ttig and
                  Stephan Aiche and
                  Knut Reinert and
                  Oliver Kohlbacher},
  editor       = {Tam{\'{a}}s Kiss},
  title        = {From the Desktop to the Grid: conversion of {KNIME} Workflows to gUSE},
  booktitle    = {Proceedings of the 5th International Workshop on Science Gateways,
                  Zurich, Switzerland, 3-5 June, 2013},
  series       = {{CEUR} Workshop Proceedings},
  volume       = {993},
  publisher    = {CEUR-WS.org},
  year         = {2013},
  url          = {https://ceur-ws.org/Vol-993/paper9.pdf},
  timestamp    = {Fri, 10 Mar 2023 16:23:48 +0100},
  biburl       = {https://dblp.org/rec/conf/iwsg/Garza0SRARK13.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@inproceedings{DBLP:conf/iwsg/Herres-PawlisHG0BKGBP13,
  author       = {Sonja Herres{-}Pawlis and
                  Alexander Hoffmann and
                  Sandra Gesing and
                  Jens Kr{\"{u}}ger and
                  {\'{A}}kos Balask{\'{o}} and
                  P{\'{e}}ter Kacsuk and
                  Richard Grunzke and
                  Georg Birkenheuer and
                  Lars Packschies},
  editor       = {Tam{\'{a}}s Kiss},
  title        = {User-Friendly Workflows in Quantum Chemistry},
  booktitle    = {Proceedings of the 5th International Workshop on Science Gateways,
                  Zurich, Switzerland, 3-5 June, 2013},
  series       = {{CEUR} Workshop Proceedings},
  volume       = {993},
  publisher    = {CEUR-WS.org},
  year         = {2013},
  url          = {https://ceur-ws.org/Vol-993/paper14.pdf},
  timestamp    = {Fri, 10 Mar 2023 00:00:00 +0100},
  biburl       = {https://dblp.org/rec/conf/iwsg/Herres-PawlisHG0BKGBP13.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/grid/NiehorsterBKK0S12,
  author       = {Oliver Nieh{\"{o}}rster and
                  Andr{\'{e}} Brinkmann and
                  Axel Keller and
                  Christoph Kleineweber and
                  Jens Kr{\"{u}}ger and
                  Jens Simon},
  title        = {Cost-Aware and SLO-Fulfilling Software as a Service},
  journal      = {J. Grid Comput.},
  volume       = {10},
  number       = {3},
  pages        = {553--577},
  year         = {2012},
  url          = {https://doi.org/10.1007/s10723-012-9230-7},
  doi          = {10.1007/S10723-012-9230-7},
  timestamp    = {Mon, 16 Sep 2019 01:00:00 +0200},
  biburl       = {https://dblp.org/rec/journals/grid/NiehorsterBKK0S12.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/grid/GesingG0BWSSSHBBKFPKBSBFMJK12,
  author       = {Sandra Gesing and
                  Richard Grunzke and
                  Jens Kr{\"{u}}ger and
                  Georg Birkenheuer and
                  Martin Wewior and
                  Patrick Sch{\"{a}}fer and
                  Bernd Schuller and
                  Johannes Schuster and
                  Sonja Herres{-}Pawlis and
                  Sebastian Breuers and
                  {\'{A}}kos Balask{\'{o}} and
                  Miklos Kozlovszky and
                  Anna Szikszay Fabri and
                  Lars Packschies and
                  P{\'{e}}ter Kacsuk and
                  Dirk Blunk and
                  Thomas Steinke and
                  Andr{\'{e}} Brinkmann and
                  Gregor Fels and
                  Ralph M{\"{u}}ller{-}Pfefferkorn and
                  Ren{\'{e}} J{\"{a}}kel and
                  Oliver Kohlbacher},
  title        = {A Single Sign-On Infrastructure for Science Gateways on a Use Case
                  for Structural Bioinformatics},
  journal      = {J. Grid Comput.},
  volume       = {10},
  number       = {4},
  pages        = {769--790},
  year         = {2012},
  url          = {https://doi.org/10.1007/s10723-012-9247-y},
  doi          = {10.1007/S10723-012-9247-Y},
  timestamp    = {Thu, 14 Oct 2021 01:00:00 +0200},
  biburl       = {https://dblp.org/rec/journals/grid/GesingG0BWSSSHBBKFPKBSBFMJK12.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcheminf/BirkenheuerBBBVFGGHK0LPMSSWW12,
  author       = {Georg Birkenheuer and
                  Dirk Blunk and
                  Sebastian Breuers and
                  Andr{\'{e}} Brinkmann and
                  Ines dos Santos Vieira and
                  Gregor Fels and
                  Sandra Gesing and
                  Richard Grunzke and
                  Sonja Herres{-}Pawlis and
                  Oliver Kohlbacher and
                  Jens Kr{\"{u}}ger and
                  Ulrich Lang and
                  Lars Packschies and
                  Ralph M{\"{u}}ller{-}Pfefferkorn and
                  Patrick Sch{\"{a}}fer and
                  Thomas Steinke and
                  Klaus{-}Dieter Warzecha and
                  Martin Wewior},
  title        = {MoSGrid: efficient data management and a standardized data exchange
                  format for molecular simulations in a grid environment},
  journal      = {J. Cheminformatics},
  volume       = {4},
  number       = {{S-1}},
  pages        = {21},
  year         = {2012},
  url          = {https://doi.org/10.1186/1758-2946-4-S1-P21},
  doi          = {10.1186/1758-2946-4-S1-P21},
  timestamp    = {Tue, 04 Jan 2022 00:00:00 +0100},
  biburl       = {https://dblp.org/rec/journals/jcheminf/BirkenheuerBBBVFGGHK0LPMSSWW12.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcheminf/RubertGHLRSKS12,
  author       = {Sebastian Rubert and
                  Christian Gamroth and
                  Andr{\'{e}} J. Heissmann and
                  Gunther Lukat and
                  Ralf Rotzoll and
                  Alexander Sch{\"{a}}fer and
                  Jens Kr{\"{u}}ger and
                  Bj{\"{o}}rn Sommer},
  title        = {The GMX-Plugin for the CELLmicrocosmos MembraneEditor},
  journal      = {J. Cheminformatics},
  volume       = {4},
  number       = {{S-1}},
  pages        = {49},
  year         = {2012},
  url          = {https://doi.org/10.1186/1758-2946-4-S1-P49},
  doi          = {10.1186/1758-2946-4-S1-P49},
  timestamp    = {Wed, 08 Dec 2021 00:00:00 +0100},
  biburl       = {https://dblp.org/rec/journals/jcheminf/RubertGHLRSKS12.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@inproceedings{DBLP:conf/healthgrid/Gesing012,
  author       = {Sandra Gesing and
                  Jens Kr{\"{u}}ger},
  editor       = {Sandra Gesing and
                  Tristan Glatard and
                  Jens Kr{\"{u}}ger and
                  S{\'{\i}}lvia Delgado Olabarriaga and
                  Tony Solomonides and
                  Jonathan C. Silverstein and
                  Johan Montagnat and
                  Alban Gaignard and
                  Dagmar Krefting},
  title        = {Workshop Series IWSG-Life},
  booktitle    = {HealthGrid Applications and Technologies Meet Science Gateways for
                  Life Sciences, Proceedings of HealthGrid 2012, Amsterdam, The Netherlands,
                  21-23 May 2012},
  series       = {Studies in Health Technology and Informatics},
  volume       = {175},
  pages        = {115--118},
  publisher    = {{IOS} Press},
  year         = {2012},
  url          = {https://doi.org/10.3233/978-1-61499-054-3-115},
  doi          = {10.3233/978-1-61499-054-3-115},
  timestamp    = {Wed, 04 Mar 2020 14:10:38 +0100},
  biburl       = {https://dblp.org/rec/conf/healthgrid/Gesing012.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@inproceedings{DBLP:conf/healthgrid/Herres-PawlisBB12,
  author       = {Sonja Herres{-}Pawlis and
                  Georg Birkenheuer and
                  Andr{\'{e}} Brinkmann and
                  Sandra Gesing and
                  Richard Grunzke and
                  Ren{\'{e}} J{\"{a}}kel and
                  Oliver Kohlbacher and
                  Jens Kr{\"{u}}ger and
                  Ines dos Santos Vieira},
  editor       = {Sandra Gesing and
                  Tristan Glatard and
                  Jens Kr{\"{u}}ger and
                  S{\'{\i}}lvia Delgado Olabarriaga and
                  Tony Solomonides and
                  Jonathan C. Silverstein and
                  Johan Montagnat and
                  Alban Gaignard and
                  Dagmar Krefting},
  title        = {Workflow-enhanced conformational analysis of guanidine zinc complexes
                  via a science gateway},
  booktitle    = {HealthGrid Applications and Technologies Meet Science Gateways for
                  Life Sciences, Proceedings of HealthGrid 2012, Amsterdam, The Netherlands,
                  21-23 May 2012},
  series       = {Studies in Health Technology and Informatics},
  volume       = {175},
  pages        = {142--151},
  publisher    = {{IOS} Press},
  year         = {2012},
  url          = {https://doi.org/10.3233/978-1-61499-054-3-142},
  doi          = {10.3233/978-1-61499-054-3-142},
  timestamp    = {Thu, 14 Oct 2021 01:00:00 +0200},
  biburl       = {https://dblp.org/rec/conf/healthgrid/Herres-PawlisBB12.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@proceedings{DBLP:conf/healthgrid/2012,
  editor       = {Sandra Gesing and
                  Tristan Glatard and
                  Jens Kr{\"{u}}ger and
                  S{\'{\i}}lvia Delgado Olabarriaga and
                  Tony Solomonides and
                  Jonathan C. Silverstein and
                  Johan Montagnat and
                  Alban Gaignard and
                  Dagmar Krefting},
  title        = {HealthGrid Applications and Technologies Meet Science Gateways for
                  Life Sciences, Proceedings of HealthGrid 2012, Amsterdam, The Netherlands,
                  21-23 May 2012},
  series       = {Studies in Health Technology and Informatics},
  volume       = {175},
  publisher    = {{IOS} Press},
  year         = {2012},
  url          = {http://ebooks.iospress.nl/volume/healthgrid-applications-and-technologies-meet-science-gateways-for-life-sciences},
  isbn         = {978-1-61499-053-6},
  timestamp    = {Wed, 04 Mar 2020 00:00:00 +0100},
  biburl       = {https://dblp.org/rec/conf/healthgrid/2012.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/concurrency/KrugerF11,
  author       = {Jens Kr{\"{u}}ger and
                  Gregor Fels},
  title        = {Ion permeation simulations by Gromacs - an example of high performance
                  molecular dynamics},
  journal      = {Concurr. Comput. Pract. Exp.},
  volume       = {23},
  number       = {3},
  pages        = {279--291},
  year         = {2011},
  url          = {https://doi.org/10.1002/cpe.1666},
  doi          = {10.1002/CPE.1666},
  timestamp    = {Mon, 02 Mar 2020 00:00:00 +0100},
  biburl       = {https://dblp.org/rec/journals/concurrency/KrugerF11.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcheminf/BirkenheuerBBBVFGGHKK0LPMSSSWW11,
  author       = {Georg Birkenheuer and
                  Dirk Blunk and
                  Sebastian Breuers and
                  Andr{\'{e}} Brinkmann and
                  Ines dos Santos Vieira and
                  Gregor Fels and
                  Sandra Gesing and
                  Richard Grunzke and
                  Sonja Herres{-}Pawlis and
                  Oliver Kohlbacher and
                  Nico Kruber and
                  Jens Kr{\"{u}}ger and
                  Ulrich Lang and
                  Lars Packschies and
                  Ralph M{\"{u}}ller{-}Pfefferkorn and
                  Patrick Sch{\"{a}}fer and
                  Hans{-}G{\"{u}}nther Schmalz and
                  Thomas Steinke and
                  Klaus{-}Dieter Warzecha and
                  Martin Wewior},
  title        = {MoSGrid - a molecular simulation grid as a new tool in computational
                  chemistry, biology and material science},
  journal      = {J. Cheminformatics},
  volume       = {3},
  number       = {{S-1}},
  pages        = {14},
  year         = {2011},
  url          = {https://doi.org/10.1186/1758-2946-3-S1-P14},
  doi          = {10.1186/1758-2946-3-S1-P14},
  timestamp    = {Tue, 04 Jan 2022 00:00:00 +0100},
  biburl       = {https://dblp.org/rec/journals/jcheminf/BirkenheuerBBBVFGGHKK0LPMSSSWW11.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcheminf/0002BBBBFGGKKLPMHSSSWW11,
  author       = {Jens Kr{\"{u}}ger and
                  Georg Birkenheuer and
                  Dirk Blunk and
                  Sebastian Breuers and
                  Andr{\'{e}} Brinkmann and
                  Gregor Fels and
                  Sandra Gesing and
                  Richard Grunzke and
                  Oliver Kohlbacher and
                  Nico Kruber and
                  Ulrich Lang and
                  Lars Packschies and
                  Ralph M{\"{u}}ller{-}Pfefferkorn and
                  Sonja Herres{-}Pawlis and
                  Patrick Sch{\"{a}}fer and
                  Hans{-}G{\"{u}}nther Schmalz and
                  Thomas Steinke and
                  Klaus{-}Dieter Warzecha and
                  Martin Wewior},
  title        = {Molecular simulation grid},
  journal      = {J. Cheminformatics},
  volume       = {3},
  number       = {{S-1}},
  pages        = {17},
  year         = {2011},
  url          = {https://doi.org/10.1186/1758-2946-3-S1-O17},
  doi          = {10.1186/1758-2946-3-S1-O17},
  timestamp    = {Tue, 04 Jan 2022 00:00:00 +0100},
  biburl       = {https://dblp.org/rec/journals/jcheminf/0002BBBBFGGKKLPMHSSSWW11.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcheminf/SommerDGHLRRS011,
  author       = {Bj{\"{o}}rn Sommer and
                  Tim Dingersen and
                  Christian Gamroth and
                  Andr{\'{e}} J. Heissmann and
                  Gunther Lukat and
                  Ralf Rotzoll and
                  Sebastian Rubert and
                  Alexander Sch{\"{a}}fer and
                  Jens Kr{\"{u}}ger},
  title        = {Coarse-grained and all-atom {MD} simulations with Gromacs based on
                  CELLmicrocosmos 2.2 model membranes},
  journal      = {J. Cheminformatics},
  volume       = {3},
  number       = {{S-1}},
  pages        = {43},
  year         = {2011},
  url          = {https://doi.org/10.1186/1758-2946-3-S1-P43},
  doi          = {10.1186/1758-2946-3-S1-P43},
  timestamp    = {Wed, 08 Dec 2021 00:00:00 +0100},
  biburl       = {https://dblp.org/rec/journals/jcheminf/SommerDGHLRRS011.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcisd/SommerDGSR0D11,
  author       = {Bj{\"{o}}rn Sommer and
                  Tim Dingersen and
                  Christian Gamroth and
                  Sebastian Schneider and
                  Sebastian Rubert and
                  Jens Kr{\"{u}}ger and
                  Karl{-}Josef Dietz},
  title        = {CELLmicrocosmos 2.2 MembraneEditor: {A} Modular Interactive Shape-Based
                  Software Approach To Solve Heterogeneous Membrane Packing Problems},
  journal      = {J. Chem. Inf. Model.},
  volume       = {51},
  number       = {5},
  pages        = {1165--1182},
  year         = {2011},
  url          = {https://doi.org/10.1021/ci1003619},
  doi          = {10.1021/CI1003619},
  timestamp    = {Wed, 08 Dec 2021 00:00:00 +0100},
  biburl       = {https://dblp.org/rec/journals/jcisd/SommerDGSR0D11.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@inproceedings{DBLP:conf/iwsg/GesingGBBBBBFHKK0PSSSSFWMK11,
  author       = {Sandra Gesing and
                  Richard Grunzke and
                  {\'{A}}kos Balask{\'{o}} and
                  Georg Birkenheuer and
                  Dirk Blunk and
                  Sebastian Breuers and
                  Andr{\'{e}} Brinkmann and
                  Gregor Fels and
                  Sonja Herres{-}Pawlis and
                  P{\'{e}}ter Kacsuk and
                  Miklos Kozlovszky and
                  Jens Kr{\"{u}}ger and
                  Lars Packschies and
                  Patrick Sch{\"{a}}fer and
                  Bernd Schuller and
                  Johannes Schuster and
                  Thomas Steinke and
                  Anna Szikszay Fabri and
                  Martin Wewior and
                  Ralph M{\"{u}}ller{-}Pfefferkorn and
                  Oliver Kohlbacher},
  editor       = {G{\'{a}}bor Tersty{\'{a}}nszky and
                  Tam{\'{a}}s Kiss},
  title        = {Granular Security for a Science Gateway in Structural Bioinformatics},
  booktitle    = {Proceedings of the 3rd International Workshop on Science Gateways
                  for Life Sciences, London, United Kingdom, June 8-10, 2011},
  series       = {{CEUR} Workshop Proceedings},
  volume       = {819},
  publisher    = {CEUR-WS.org},
  year         = {2011},
  url          = {https://ceur-ws.org/Vol-819/paper8.pdf},
  timestamp    = {Fri, 10 Mar 2023 16:23:48 +0100},
  biburl       = {https://dblp.org/rec/conf/iwsg/GesingGBBBBBFHKK0PSSSSFWMK11.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcheminf/0002F10,
  author       = {Jens Kr{\"{u}}ger and
                  Gregor Fels},
  title        = {Ion permeation through neuronal nAChR ion channel},
  journal      = {J. Cheminformatics},
  volume       = {2},
  number       = {{S-1}},
  pages        = {23},
  year         = {2010},
  url          = {https://doi.org/10.1186/1758-2946-2-S1-O23},
  doi          = {10.1186/1758-2946-2-S1-O23},
  timestamp    = {Thu, 14 Feb 2019 00:00:00 +0100},
  biburl       = {https://dblp.org/rec/journals/jcheminf/0002F10.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@inproceedings{DBLP:conf/cluster/NiehorsterBFKS10,
  author       = {Oliver Nieh{\"{o}}rster and
                  Andr{\'{e}} Brinkmann and
                  Gregor Fels and
                  Jens Kr{\"{u}}ger and
                  Jens Simon},
  title        = {Enforcing SLAs in Scientific Clouds},
  booktitle    = {Proceedings of the 2010 {IEEE} International Conference on Cluster
                  Computing, Heraklion, Crete, Greece, 20-24 September, 2010},
  pages        = {178--187},
  publisher    = {{IEEE} Computer Society},
  year         = {2010},
  url          = {https://doi.org/10.1109/CLUSTER.2010.42},
  doi          = {10.1109/CLUSTER.2010.42},
  timestamp    = {Thu, 23 Mar 2023 00:00:00 +0100},
  biburl       = {https://dblp.org/rec/conf/cluster/NiehorsterBFKS10.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@inproceedings{DBLP:conf/se/BirkenheuerBBBFGHKKP10,
  author       = {Georg Birkenheuer and
                  Sebastian Breuers and
                  Andr{\'{e}} Brinkmann and
                  Dirk Blunk and
                  Gregor Fels and
                  Sandra Gesing and
                  Sonja Herres{-}Pawlis and
                  Oliver Kohlbacher and
                  Jens Kr{\"{u}}ger and
                  Lars Packschies},
  editor       = {Gregor Engels and
                  Markus Luckey and
                  Alexander Pretschner and
                  Ralf H. Reussner},
  title        = {Grid-Workflows in Molecular Science},
  booktitle    = {Software Engineering 2010 - Workshopband (inkl. Doktorandensymposium),
                  Fachtagung des GI-Fachbereichs Softwaretechnik, 22.-26.02.2010, Paderborn},
  series       = {{LNI}},
  volume       = {{P-160}},
  pages        = {177--184},
  publisher    = {{GI}},
  year         = {2010},
  url          = {https://dl.gi.de/handle/20.500.12116/20151},
  timestamp    = {Tue, 04 Jul 2023 01:00:00 +0200},
  biburl       = {https://dblp.org/rec/conf/se/BirkenheuerBBBFGHKKP10.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@inproceedings{DBLP:conf/iwsg/0002F09,
  author       = {Jens Kr{\"{u}}ger and
                  Gregor Fels},
  editor       = {Sandra Gesing and
                  Jano I. van Hemert},
  title        = {Potential of Mean Force of Ion Permeation through alpha7 nAChRIon
                  Channel},
  booktitle    = {Proceedings of the International Workshop on Portals for Life Sciences,
                  {IWPLS} 2009, Edinburgh, UK, September 14-15, 2009},
  series       = {{CEUR} Workshop Proceedings},
  volume       = {513},
  publisher    = {CEUR-WS.org},
  year         = {2009},
  url          = {https://ceur-ws.org/Vol-513/paper06.pdf},
  timestamp    = {Fri, 10 Mar 2023 16:23:48 +0100},
  biburl       = {https://dblp.org/rec/conf/iwsg/0002F09.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/jcc/KrugerF08,
  author       = {Jens Kr{\"{u}}ger and
                  Wolfgang B. Fischer},
  title        = {Exploring the conformational space of Vpu from {HIV-1:} {A} versatile
                  adaptable protein},
  journal      = {J. Comput. Chem.},
  volume       = {29},
  number       = {14},
  pages        = {2416--2424},
  year         = {2008},
  url          = {https://doi.org/10.1002/jcc.20986},
  doi          = {10.1002/JCC.20986},
  timestamp    = {Wed, 01 Apr 2020 01:00:00 +0200},
  biburl       = {https://dblp.org/rec/journals/jcc/KrugerF08.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
@article{DBLP:journals/cce/YangSBKHM03,
  author       = {Aidong Yang and
                  Marcus Schl{\"{u}}ter and
                  Birgit Bayer and
                  Jens Kr{\"{u}}ger and
                  Edmund Haberstroh and
                  Wolfgang Marquardt},
  title        = {A concise conceptual model for material data and its applications
                  in process engineering},
  journal      = {Comput. Chem. Eng.},
  volume       = {27},
  number       = {4},
  pages        = {595--609},
  year         = {2003},
  url          = {https://doi.org/10.1016/S0098-1354(02)00237-5},
  doi          = {10.1016/S0098-1354(02)00237-5},
  timestamp    = {Wed, 20 Sep 2023 01:00:00 +0200},
  biburl       = {https://dblp.org/rec/journals/cce/YangSBKHM03.bib},
  bibsource    = {dblp computer science bibliography, https://dblp.org}
}
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