Andreas W. Götz
www.awgoetz.de
0000-0002-8048-6906
University of California
5 papers found
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Amber free energy tools: Interoperable software for free energy simulations using generalized quantum mechanical/molecular mechanical and machine learning potentials
AmberTools
Solvation Free Energies and Adsorption Energies at the Metal/Water Interface from Hybrid Quantum-Mechanical/Molecular Mechanics Simulations
Force Field for Water over Pt(111): Development, Assessment, and Comparison
Molecular mechanics models for the image charge, a comment on “including image charge effects in the molecular dynamics simulations of molecules on metal surfaces”
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