ForceBalance API
1.3
Automated optimization of force fields and empirical potentials
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Go to the source code of this file.
Classes | |
class | src.vibration.Vibration |
Subclass of Target for fitting force fields to vibrational spectra (from experiment or theory). More... | |
Namespaces | |
src.vibration | |
forcebalance.vibration | |
Vibrational mode fitting module. | |
Functions | |
def | src.vibration.count_assignment (assignment, verbose=True) |
Variables | |
src.vibration.logger = getLogger(__name__) | |