Skip to content

Separate RejectionFlag and MergedData for sum and profile integration

Zamaan Raza requested to merge profile-completeness into main

The existence of a single shared RejectionFlag for sum and profile integration resulted in erroneous completeness statistics. Now there are separate

  • RejectionFlags for sum and profile integration
  • MergedData objects for sum and profile integration

Moreover, the CC calculation has been corrected such that profile integration does not result in NaNs. SubframeMerge has been updated to include separate sum and profile sections for merged and unmerged peaks, and the profile/unmerged table has been fixed to show the correct intensities and sigmas.

Resolves #637 (closed) and #632 (closed)

Merge request reports