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look at graph isomorphism check in rmg. #9

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ChrisBNEU opened this issue Jul 18, 2023 · 0 comments
Open

look at graph isomorphism check in rmg. #9

ChrisBNEU opened this issue Jul 18, 2023 · 0 comments
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@sevyharris @12Chao

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@ChrisBNEU
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investigate graph isomorphism check in rmg. Possibly we can speed it up by writing entire trees to a gpu, then parallelizing the check of each molecule to every node in the tree.
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@12Chao 12Chao

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@sevyharris @12Chao @ChrisBNEU