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20102026
most citedOGB-LSC: A Large-Scale Challenge for Machine Learning on Graphs

121 citations · 230 across the 13 of their papers we have counts for

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physics.chem-ph2015★ 1 cited

The PubChemQC Project: a large chemical database from the first principle calculations

Maho Nakata

In this research, we have been constructing a large database of molecules by {\it ab initio} calculations. Currently, we have over 1.53 million entries of 6-31G* B3LYP optimized ge…