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1 parent 11e3dc2 commit 7ddfb69Copy full SHA for 7ddfb69
arc/job/adapter.py
@@ -101,6 +101,7 @@ class JobEnum(str, Enum):
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gcn = 'gcn' # Graph neural network for isomerization, https://doi.org/10.1021/acs.jpclett.0c00500
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user = 'user' # user guesses
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xtb_gsm = 'xtb_gsm' # Double ended growing string method (DE-GSM), [10.1021/ct400319w, 10.1063/1.4804162] via xTB
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+ orca_neb = 'orca_neb'
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class JobTypeEnum(str, Enum):
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