Ticket #4596 (closed: fixed)

Opened 9 years ago

Last modified 5 years ago

Sorting and grouping of single crystal data by hkl indices

Reported by: Vickie Lynch Owned by: Vickie Lynch
Priority: major Milestone: Release 2.1
Component: Mantid Keywords:
Cc: zikovskyjl@… Blocked By:
Blocking: Tester: Janik Zikovsky

Description

Peak workspaces should be sorted by hkl and then create output workspace containing the statistics of peaks with the same hkl.

Attachments

RotationDet.hkl (23.5 KB) - added by Vickie Lynch 9 years ago.

Change History

comment:1 Changed 9 years ago by Vickie Lynch

  • Status changed from new to accepted

comment:2 Changed 9 years ago by Vickie Lynch

Refs #4596 SortHKL algorithm added

Changeset: acbce32bffeecc8f306e0b3160beaf051619347a

comment:3 Changed 9 years ago by Vickie Lynch

Refs #4596 output statistics table

Changeset: fdf06a7ca24e61343dbb574a14bbd37b257e8fa7

comment:4 Changed 9 years ago by Vickie Lynch

Refs #4596 need algorithm to load hkl file Changeset: 321fa55a395b645bb6684a8052764b90c58508c3

comment:5 Changed 9 years ago by Vickie Lynch

Refs #4596 new constructor includes scattering angle from hkl file

Changeset: 8f912c8740555c193b7ac4e0f9870f4189399b84

comment:6 Changed 9 years ago by Vickie Lynch

Refs #4596 reset hkl of equivalent peaks to original value after sort

Changeset: c8d9e410cf7451e50eb8b29988fb2e1397c60052

comment:7 Changed 9 years ago by Vickie Lynch

Refs #4596 read data without spaces between columns

Changeset: 85dca41ae49a1339d8223452109b217a6aff83d1

comment:8 Changed 9 years ago by Vickie Lynch

Refs #4596 correct substrings

Changeset: 732843a064c76792256c99d30f2bea8b08baf55f

comment:9 Changed 9 years ago by Vickie Lynch

Refs #4596 reset hkl of equivalent peak to original value after sort

Changeset: c85f5e421663115045c5c6abb2ab004cb7a9c07c

comment:10 Changed 9 years ago by Vickie Lynch

Refs #4596 do not resort by hkl for grouped by equivalent hkl

Changeset: a4f5b96be11a21bec4e1937353b4581a70b02e20

comment:11 Changed 9 years ago by Vickie Lynch

Refs #4596 test for LoadHKL

Changeset: f9bf391b5a209a3f6b0eb620d5e59835d2698540

comment:12 Changed 9 years ago by Vickie Lynch

Refs #4596 fix test for snowleopard

Changeset: 6b148bad2e86d6d2caa56a74644c2d02ea1057d8

comment:13 Changed 9 years ago by Vickie Lynch

Refs #4596 test for LoadHKL

Changeset: f9bf391b5a209a3f6b0eb620d5e59835d2698540

comment:14 Changed 9 years ago by Vickie Lynch

Refs #4596 fix test for snowleopard

Changeset: 6b148bad2e86d6d2caa56a74644c2d02ea1057d8

comment:15 Changed 9 years ago by Vickie Lynch

Refs #4596 test for SortHKL

Changeset: 1117f4bd905b0a098158a7a9d6eed04eab83d641

Changed 9 years ago by Vickie Lynch

comment:16 Changed 9 years ago by Vickie Lynch

  • Status changed from accepted to verify
  • Resolution set to fixed

Test LoadHKL and SortHKL with attached file.

comment:17 Changed 8 years ago by Janik Zikovsky

  • Status changed from verify to verifying
  • Tester set to Janik Zikovsky

comment:18 Changed 8 years ago by Janik Zikovsky

  • Status changed from verifying to closed

Works with the exception of ticket #5189

comment:19 Changed 8 years ago by Janik Zikovsky

One thing I noticed is that the symmetric peaks are NOT removed. Not sure if that's the desired behavior.

comment:20 Changed 5 years ago by Stuart Campbell

This ticket has been transferred to github issue 5443

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