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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.binding.BindingEnergy |
| Improved subclass of Target for fitting force fields to binding energies. More... | |
Namespaces | |
| src.binding | |
| forcebalance.binding | |
| Binding energy fitting module. | |
Functions | |
| def | src.binding.parse_interactions (input_file) |
| Parse through the interactions input file. More... | |
Variables | |
| src.binding.logger = getLogger(__name__) | |
1.8.13