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tm-QMg-L dataset #22

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ghutchis opened this issue Jan 23, 2024 · 0 comments

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ghutchis commented Jan 23, 2024

More ligands can be found here:
https://github.com/hkneiding/tmQMg-L

Directional Multiobjective Optimization of Metal Complexes at the Billion-Scale with the tmQMg-L Dataset and PL-MOGA Algorithm
https://doi.org/10.26434/chemrxiv-2023-k3tf2-v2

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