Carsten Kutzner

According to our database, Carsten Kutzner authored at least 13 papers between 2006 and 2025.

Collaborative distances:

• Dijkstra number of four.
• Erdős number of four.

2025

Scaling of the GROMACS Molecular Dynamics Code to 65k CPU Cores on an HPC Cluster.

Carsten Kutzner, Vedran Miletic, Karen Palacio Rodríguez, Markus Rampp, Gerhard Hummer, Bert L. de Groot, Helmut Grubmüller

J. Comput. Chem., 2025

2024

Constant pH Simulation with FMM Electrostatics in GROMACS. (B) GPU Accelerated Hamiltonian Interpolation.

Bartosz Kohnke, Eliane Briand, Carsten Kutzner, Helmut Grubmüller

CoRR, 2024

Constant pH Simulation with FMM Electrostatics in GROMACS. (A) Design and Applications.

Eliane Briand, Bartosz Kohnke, Carsten Kutzner, Helmut Grubmüller

CoRR, 2024

2022

GROMACS in the Cloud: A Global Supercomputer to Speed Up Alchemical Drug Design.

Carsten Kutzner, Christian Kniep, Austin Cherian, Ludvig Nordstrom, Helmut Grubmüller, Bert L. de Groot, Vytautas Gapsys

J. Chem. Inf. Model., 2022

2021

A CUDA fast multipole method with highly efficient M2L far field evaluation.

Bartosz Kohnke, Carsten Kutzner, Andreas Beckmann, Gert Lube, Ivo Kabadshow, Holger Dachsel, Helmut Grubmüller

Int. J. High Perform. Comput. Appl., 2021

2020

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

Bartosz Kohnke, Thomas R. Ullmann, Andreas Beckmann, Ivo Kabadshow, David Haensel, Laura Morgenstern, Plamen Dobrev, Gerrit Groenhof, Carsten Kutzner, Berk Hess, Holger Dachsel, Helmut Grubmüller

Proceedings of the Software for Exascale Computing - SPPEXA 2016-2019, 2020

2019

More bang for your buck: Improved use of GPU nodes for GROMACS 2018.

Carsten Kutzner, Szilárd Páll, Martin Fechner, Ansgar Esztermann, Bert L. de Groot, Helmut Grubmüller

J. Comput. Chem., 2019

2015

Best bang for your buck: GPU nodes for GROMACS biomolecular simulations.

Carsten Kutzner, Szilárd Páll, Martin Fechner, Ansgar Esztermann, Bert L. de Groot, Helmut Grubmüller

J. Comput. Chem., 2015

2014

Tackling Exascale Software Challenges in Molecular Dynamics Simulations with GROMACS.

Szilárd Páll, Mark James Abraham, Carsten Kutzner, Berk Hess, Erik Lindahl

Proceedings of the Solving Software Challenges for Exascale, 2014

2013

Scaling of the GROMACS 4.6 molecular dynamics code on SuperMUC.

Carsten Kutzner, Rossen Apostolov, Berk Hess, Helmut Grubmüller

Proceedings of the Parallel Computing: Accelerating Computational Science and Engineering (CSE), 2013

Extreme Scaling Workshop at the LRZ.

Momme Allalen, Gurvan Bazin, Christoph Bernau, Arndt Bode, David Brayford, Matthias Brehm, Jürg Diemand, Klaus Dolag, Jan Engels, Nicolay Hammer, Herbert Huber, Ferdinand Jamitzky, Anupam Karmakar, Carsten Kutzner, Andreas Marek, Carmen B. Navarrete, Helmut Satzger, Wolfram Schmidt, Philipp Trisjono

Proceedings of the Parallel Computing: Accelerating Computational Science and Engineering (CSE), 2013

2007

Speeding up parallel GROMACS on high-latency networks.

Carsten Kutzner, David van der Spoel, Martin Fechner, Erik Lindahl, Udo W. Schmitt, Bert L. de Groot, Helmut Grubmüller

J. Comput. Chem., 2007

2006

Improved GROMACS Scaling on Ethernet Switched Clusters.

Carsten Kutzner, David van der Spoel, Martin Fechner, Erik Lindahl, Udo W. Schmitt, Bert L. de Groot, Helmut Grubmüller

Proceedings of the Recent Advances in Parallel Virtual Machine and Message Passing Interface, 2006