Implement image-pair regeneration with DHS (-GS) and i-EIP - Githubissues

duartegroup / autodE

automated reaction profile generation

https://duartegroup.github.io/autodE/

MIT License

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Implement image-pair regeneration with DHS (-GS) and i-EIP #301

Open shoubhikraj opened 1 year ago

shoubhikraj commented 1 year ago

Image pair regen with spline or 1D cubic polynomial fit.