Andreas W. Götz
Orcid: 0000-0002-8048-6906
According to our database1,
Andreas W. Götz
authored at least 13 papers
between 2005 and 2023.
Collaborative distances:
Collaborative distances:
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Bibliography
2023
Quantum Mechanics/Molecular Mechanics Simulations on NVIDIA and AMD Graphics Processing Units.
J. Chem. Inf. Model., February, 2023
Developing a Best Practices Training Program in Cyberinfrastructure-Enabled Machine Learning Research.
Proceedings of the Practice and Experience in Advanced Research Computing, 2023
2021
J. Chem. Inf. Model., 2021
2017
Molecular mechanics models for the image charge, a comment on "including image charge effects in the molecular dynamics simulations of molecules on metal surfaces".
J. Comput. Chem., 2017
Analytical gradients for subsystem density functional theory within the slater-function-based amsterdam density functional program.
J. Comput. Chem., 2017
Combined quantum-mechanical molecular mechanics calculations with NWChem and AMBER: Excited state properties of green fluorescent protein chromophore analogue in aqueous solution.
J. Comput. Chem., 2017
J. Comput. Chem., 2017
2015
J. Comput. Chem., 2015
2014
J. Comput. Chem., 2014
2013
SPFP: Speed without compromise - A mixed precision model for GPU accelerated molecular dynamics simulations.
Comput. Phys. Commun., 2013
2011
J. Comput. Chem., 2011
2005
Optimization of auxiliary basis sets for the LEDO expansion and a projection technique for LEDO-DFT.
J. Comput. Chem., 2005