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1 |
| -# Version 1.0 |
| 1 | +# SpectraTutorials 1.0 |
2 | 2 |
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| 3 | +## Changes in 1.0.1 |
| 4 | + |
| 5 | +- Add Zenodo doi to citation file and README. |
| 6 | + |
| 7 | +## Changes in 1.0.0 |
| 8 | + |
| 9 | +- Version published on https://doi.org/10.5281/zenodo.11210190 |
3 | 10 | - Use R 4.4 and Bioconductor 3.19.
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4 | 11 |
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5 |
| -# Version 0.9 |
| 12 | +# SpectraTutorials 0.9 |
6 | 13 |
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7 |
| -## Version 0.9.0 |
| 14 | +## Changes in 0.9.0 |
8 | 15 |
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9 | 16 | - Use R 4.3 and Bioconductor 3.18.
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10 | 17 |
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11 |
| -# Version 0.8 |
| 18 | +# SpectraTutorials 0.8 |
12 | 19 |
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13 |
| -## Version 0.8.2 |
| 20 | +## Changes in 0.8.2 |
14 | 21 |
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15 | 22 | - Add second example why caching changes is better than saving to database.
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16 | 23 |
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17 |
| -## Version 0.8.1 |
| 24 | +## Changes in 0.8.1 |
18 | 25 |
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19 | 26 | - Include feedback and suggestions from Philippine Louail.
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20 | 27 |
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21 |
| -## Version 0.8.0 |
| 28 | +## Changes in 0.8.0 |
22 | 29 |
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23 | 30 | - Add new tutorial *`Spectra`: an expandable infrastructure to handle mass
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24 | 31 | spectrometry data*.
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25 | 32 | - Download MassBank data as an alternative from *AnnotationHub*.
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26 | 33 |
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27 |
| -# Version 0.7 |
| 34 | +# SpectraTutorials 0.7 |
28 | 35 |
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29 |
| -## Version 0.7.3 |
| 36 | +## Changes in 0.7.3 |
30 | 37 |
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31 | 38 | - Fix mislabeling columns as experimental spectra and rows as MassBank spectra
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32 | 39 | in the spectra similarity matrix (thanks to CSAMA2023 attendee for pointing
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33 | 40 | this out!).
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34 | 41 |
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35 |
| -## Version 0.7.2 |
| 42 | +## Changes in 0.7.2 |
36 | 43 |
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37 | 44 | - Use `MsBackendSql` instead of `MsqlBackend`.
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38 | 45 |
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39 |
| -## Version 0.7.1 |
| 46 | +## Changes in 0.7.1 |
40 | 47 |
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41 | 48 | - Simplify/clarify description of spectra data processing.
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42 | 49 |
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43 |
| -## Version 0.7.0 |
| 50 | +## Changes in 0.7.0 |
44 | 51 |
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45 | 52 | - Add section on the use of the `MsqlBackend` and compare performance to
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46 | 53 | `MsBackendMzR` and `MsBackendDataFrame`.
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47 | 54 |
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48 |
| -# Version 0.6 |
| 55 | +# SpectraTutorials 0.6 |
49 | 56 |
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50 |
| -## Version 0.6.3 |
| 57 | +## Changes in 0.6.3 |
51 | 58 |
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52 | 59 | - Better describe usage of the alternative SQLite MassBank database file in the
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53 | 60 | two workshops.
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54 | 61 |
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55 |
| -## Version 0.6.2 |
| 62 | +## Changes in 0.6.2 |
56 | 63 |
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57 | 64 | - Add citation.
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58 | 65 |
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59 |
| -## Version 0.6.1 |
| 66 | +## Changes in 0.6.1 |
60 | 67 |
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61 | 68 | - Adapt to changes in `Spectra` >= 1.5.8: export `spectraVariableMapping`
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62 | 69 | method.
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65 | 72 | - Adapt to changes in `MetaboAnnotation` >= 0.99.4: also the ppm error is
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66 | 73 | reported by `matchMz`.
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67 | 74 |
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68 |
| -## Version 0.6.0 |
| 75 | +## Changes in 0.6.0 |
69 | 76 |
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70 | 77 | - Remove the `Spectra` object with data from HMDB.
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71 | 78 | - Use a `CompDb` database for HMDB annotations.
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72 | 79 |
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73 |
| -# Version 0.5 |
| 80 | +# SpectraTutorials 0.5 |
74 | 81 |
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75 |
| -## Version 0.5.0 |
| 82 | +## Changes in 0.5.0 |
76 | 83 |
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77 | 84 | - Add additional vignette describing spectra matching with the
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78 | 85 | `MetaboAnnotation` package and integration into an `xcms` analysis workflow.
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79 | 86 |
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80 |
| -# Version 0.4 |
| 87 | +# SpectraTutorials 0.4 |
81 | 88 |
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82 |
| -## Version 0.4.0 |
| 89 | +## Changes in 0.4.0 |
83 | 90 |
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84 | 91 | - Version used at the BioC2021 conference.
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85 | 92 | - Use MassBank release 2021.03.
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86 | 93 | - Restructure the document and simplify the analysis (reduce to mzML files with
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87 | 94 | 20eV collision energy).
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88 | 95 |
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89 |
| -# Version 0.3 |
| 96 | +# SpectraTutorials 0.3 |
90 | 97 |
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91 |
| -## Version 0.3.2 |
| 98 | +## Changes in 0.3.2 |
92 | 99 |
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93 | 100 | - Use MassBank release 2021.02 and add expand descriptive text.
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