masster 0.4.3__py3-none-any.whl → 0.4.5__py3-none-any.whl

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Files changed (54) hide show
  1. masster/__init__.py +8 -8
  2. masster/_version.py +1 -1
  3. masster/chromatogram.py +1 -1
  4. masster/data/dda/20250530_VH_IQX_KW_RP_HSST3_100mm_12min_pos_v4_DDA_OT_C-MiLUT_QC_dil2_01_20250602151849.sample5 +0 -0
  5. masster/data/dda/20250530_VH_IQX_KW_RP_HSST3_100mm_12min_pos_v4_DDA_OT_C-MiLUT_QC_dil3_01_20250602150634.sample5 +0 -0
  6. masster/data/dda/20250530_VH_IQX_KW_RP_HSST3_100mm_12min_pos_v4_MS1_C-MiLUT_C008_v6_r38_01.sample5 +0 -0
  7. masster/data/dda/20250530_VH_IQX_KW_RP_HSST3_100mm_12min_pos_v4_MS1_C-MiLUT_C008_v7_r37_01.sample5 +0 -0
  8. masster/data/dda/20250530_VH_IQX_KW_RP_HSST3_100mm_12min_pos_v4_MS1_C-MiLUT_C017_v5_r99_01.sample5 +0 -0
  9. masster/data/libs/__pycache__/ccm.cpython-312.pyc +0 -0
  10. masster/data/libs/__pycache__/urine.cpython-312.pyc +0 -0
  11. masster/data/libs/ccm.csv +120 -0
  12. masster/data/libs/urine.csv +4693 -0
  13. masster/data/wiff/2025_01_14_VW_7600_LpMx_DBS_CID_2min_TOP15_030msecMS1_005msecReac_CE35_DBS-ON_3.timeseries.data +0 -0
  14. masster/data/wiff/2025_01_14_VW_7600_LpMx_DBS_CID_2min_TOP15_030msecMS1_005msecReac_CE35_DBS-ON_3.wiff +0 -0
  15. masster/data/wiff/2025_01_14_VW_7600_LpMx_DBS_CID_2min_TOP15_030msecMS1_005msecReac_CE35_DBS-ON_3.wiff.scan +0 -0
  16. masster/data/wiff/2025_01_14_VW_7600_LpMx_DBS_CID_2min_TOP15_030msecMS1_005msecReac_CE35_DBS-ON_3.wiff2 +0 -0
  17. masster/logger.py +11 -11
  18. masster/sample/__init__.py +1 -1
  19. masster/sample/adducts.py +338 -264
  20. masster/sample/defaults/find_adducts_def.py +21 -8
  21. masster/sample/h5.py +561 -282
  22. masster/sample/helpers.py +131 -75
  23. masster/sample/lib.py +4 -4
  24. masster/sample/load.py +31 -17
  25. masster/sample/parameters.py +1 -1
  26. masster/sample/plot.py +7 -7
  27. masster/sample/processing.py +117 -87
  28. masster/sample/sample.py +103 -90
  29. masster/sample/sample5_schema.json +196 -0
  30. masster/sample/save.py +35 -12
  31. masster/spectrum.py +1 -1
  32. masster/study/__init__.py +1 -1
  33. masster/study/defaults/align_def.py +5 -1
  34. masster/study/defaults/identify_def.py +3 -1
  35. masster/study/defaults/study_def.py +58 -25
  36. masster/study/export.py +360 -210
  37. masster/study/h5.py +560 -158
  38. masster/study/helpers.py +496 -203
  39. masster/study/helpers_optimized.py +1 -1
  40. masster/study/id.py +538 -349
  41. masster/study/load.py +233 -143
  42. masster/study/plot.py +71 -71
  43. masster/study/processing.py +456 -254
  44. masster/study/save.py +15 -5
  45. masster/study/study.py +213 -131
  46. masster/study/study5_schema.json +360 -0
  47. masster-0.4.5.dist-info/METADATA +131 -0
  48. masster-0.4.5.dist-info/RECORD +71 -0
  49. masster-0.4.3.dist-info/METADATA +0 -791
  50. masster-0.4.3.dist-info/RECORD +0 -56
  51. {masster-0.4.3.dist-info → masster-0.4.5.dist-info}/WHEEL +0 -0
  52. {masster-0.4.3.dist-info → masster-0.4.5.dist-info}/entry_points.txt +0 -0
  53. {masster-0.4.3.dist-info → masster-0.4.5.dist-info}/licenses/LICENSE +0 -0
  54. {masster-0.4.3.dist-info → masster-0.4.5.dist-info}/top_level.txt +0 -0
masster-0.4.3.dist-info/RECORD DELETED
@@ -1,56 +0,0 @@
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- masster/sample/defaults/find_features_def.py,sha256=Bcd39uav1BniwKgrsB-I1maF3ljf4Wb1f5yv0pDYfts,17745
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- masster/study/defaults/fill_chrom_def.py,sha256=hB6-tyC9bhx-IpGj2HC8FinQdW4VLYj_pn5t1rlj-Ew,8887
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- masster/study/defaults/find_consensus_def.py,sha256=uWB4NKCXDMQgNp4BaQUExkDofnXz0ZDffsxH1tvH2_Q,8599
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- masster-0.4.3.dist-info/RECORD,,