Script for data generation and Code for our article "Predicting the future of excitation energy transfer in light-harvesting complex with artificial intelligence-based quantum dynamics"
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Updated
Jun 18, 2024 - Python
Script for data generation and Code for our article "Predicting the future of excitation energy transfer in light-harvesting complex with artificial intelligence-based quantum dynamics"
Graphical user interface for molecular modeling
FMO境界処理と矩形変換による混成軌道の除去 / Removing hybrid orbitals at FMO fragment boundaries via a rectangular transformation
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