Open mgiulini opened 4 days ago
Obviously trying to calculate an ilrmsdmatrix for a single chain ensemble does not make sense. But the current error message is not clear enough about the nature of the error. Thanks @VGPReys for spotting this
Obviously trying to calculate an ilrmsdmatrix for a single chain ensemble does not make sense. But the current error message is not clear enough about the nature of the error. Thanks @VGPReys for spotting this