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See figure 5 in AtmoSpec paper -- it currently says
1 singlet states, 500 Wigner samples
but should be something like
1 singlet state, 500 Wigner samples per conformer, 2 conformers
The text was updated successfully, but these errors were encountered:
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See figure 5 in AtmoSpec paper -- it currently says
but should be something like
The text was updated successfully, but these errors were encountered: