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More parameters added to MFAssignR: MFAssignCHO and MFAssign function #595

Merged
merged 23 commits into from
Oct 22, 2024
Merged

More parameters added to MFAssignR: MFAssignCHO and MFAssign function #595

merged 23 commits into from
Oct 22, 2024

Commits on Oct 16, 2024

  1. added parameters to MFAssignCHO

    @KristinaGomoryova
    KristinaGomoryova committed Oct 16, 2024
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Commits on Oct 17, 2024

  1. added more parameters to mfassigncho

    @KristinaGomoryova
    KristinaGomoryova committed Oct 17, 2024
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  2. parameters set as required, not optional

    @KristinaGomoryova
    KristinaGomoryova committed Oct 17, 2024
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  3. new parameters packed into 'Advanced' tab

    @KristinaGomoryova
    KristinaGomoryova committed Oct 17, 2024
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Commits on Oct 18, 2024

  1. labels in advanced tab made more descriptive

    @KristinaGomoryova
    KristinaGomoryova committed Oct 18, 2024
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  2. data types updated

    @KristinaGomoryova
    KristinaGomoryova committed Oct 18, 2024
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  3. odd electron ions assignment based on ionMode

    @KristinaGomoryova
    KristinaGomoryova committed Oct 18, 2024
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  4. parameters for MFAssign/CHO restructured and updated

    @KristinaGomoryova
    KristinaGomoryova committed Oct 18, 2024
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  5. default value for DeNovo parameter in MFAssign set to 300

    @KristinaGomoryova
    KristinaGomoryova committed Oct 18, 2024
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Commits on Oct 21, 2024

  1. O_min data type and min changed

    @KristinaGomoryova
    KristinaGomoryova committed Oct 21, 2024
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  2. DBE helptext adjusted

    @KristinaGomoryova
    KristinaGomoryova committed Oct 21, 2024
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  3. Zx min and max values provided

    @KristinaGomoryova
    KristinaGomoryova committed Oct 21, 2024
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  4. iso_err boundaries adjusted

    @KristinaGomoryova
    KristinaGomoryova committed Oct 21, 2024
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  5. S34 and C13 boundaries set

    @KristinaGomoryova
    KristinaGomoryova committed Oct 21, 2024
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  6. mfassign valence params put into separate macro

    @KristinaGomoryova
    KristinaGomoryova committed Oct 21, 2024
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  7. mfassign ratios put into separate macro

    @KristinaGomoryova
    KristinaGomoryova committed Oct 21, 2024
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  8. set amount of elements as section

    @KristinaGomoryova
    KristinaGomoryova committed Oct 21, 2024
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  9. ratios set as a section

    @KristinaGomoryova
    KristinaGomoryova committed Oct 21, 2024
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  10. other parameters

    @KristinaGomoryova
    KristinaGomoryova committed Oct 21, 2024
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  11. other params as section in mfassign

    @KristinaGomoryova
    KristinaGomoryova committed Oct 21, 2024
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  12. assignment to sections updated

    @KristinaGomoryova
    KristinaGomoryova committed Oct 21, 2024
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  13. galaxy version bumped

    @KristinaGomoryova
    KristinaGomoryova committed Oct 21, 2024
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  14. if..else statement adjusted

    @KristinaGomoryova
    KristinaGomoryova committed Oct 21, 2024
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