Analysis scripts for the CHARMM GUI Drude Prepper Paper
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Updated
Sep 16, 2021 - Rich Text Format
Analysis scripts for the CHARMM GUI Drude Prepper Paper
Steinmetz, A. Modern topics in relativistic spin dynamics and magnetism. PhD dissertation. University of Arizona, 2023.
Electromagnetic field analysis in Python
Steinmetz, A., Formanek, M. & Rafelski, J. Magnetic dipole moment in relativistic quantum mechanics. Eur. Phys. J. A 55, 40 (2019).
Predicting Amino Acids' Dipole Moment Value using SchNet
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