Mercurial > repos > ppericard > mixomics_blocksplsda

annotate mixomics_blocksplsda.xml @ 5:1ee8d2c20c0a draft

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planemo upload for repository https://github.com/bilille/galaxy-mixomics-blocksplsda commit 25773bd7a90072f9782df823969b282e4fe29252
author ppericard
date Tue, 10 Mar 2020 06:27:02 -0400
parents b0ab97ffc2a1
children
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1 <tool id="mixomics_blocksplsda" name="mixOmics block.splsda" version="0.4.0" profile="16.04" workflow_compatible="true">
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2
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3 <description>performs N-integration and feature selection with Projection to Latent Structures models (PLS) with sparse Discriminant Analysis</description>
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4
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5 <requirements>
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6 <requirement type="package" version="6.8">bioconductor-mixomics</requirement>
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7 <requirement type="package" version="2.0">r-argparse</requirement>
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8 </requirements>
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9
0
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10 <!-- <stdio>
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11 <exit_code range="1:" level="fatal" />
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12 </stdio> -->
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13
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14 <command detect_errors="aggressive">
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15 <![CDATA[
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16 mkdir outdir
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17 && Rscript
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18 ${__tool_directory__}/mixomics_blocksplsda_script.R
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19 #for $b in $blocks
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20 --block
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21 #if $b.block_name
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22 ${b.block_name}
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23 #else
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24 ${b.data_matrix.name}
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25 #end if
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26 ${b.keep}
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27 ${b.data_matrix}
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28 ${b.variable_metadata}
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29 #end for
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30 --sample_metadata_in ${sample_metadata_in}
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31 --sample_description_col ${sample_description_col}
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32 --ncomp ${ncomp}
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33 ${correlation}
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34 ##--scheme ${adv.scheme}
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35 ##--mode ${adv.mode}
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36 --maxiter ${adv.maxiter}
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37 ##${adv.scale}
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38 --scale ## always activated hidden param
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39 ##--init ${adv.init}
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40 ##--tol ${adv.tol}
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41 ##${adv.nearzerovar}
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42 --rdata_out ${rdata_out}
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43 --sample_metadata_out ${sample_metadata_out}
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44 --variable_metadata_outdir outdir
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45 ]]>
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46 </command>
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47
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48 <inputs>
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49 <repeat name="blocks" title="Blocks">
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50 <param name="block_name" type="text" label="Block name" />
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51 <param name="keep" type="integer" value="0" min="0"
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52 label="Number of variables to select for each component"
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53 help="[keep] Estimation of the number of variables in the block correlated with variables from the other blocks and correlated with response variables. If set to 0, all variables will be selected." />
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54 <param name="data_matrix" type="data" format="tabular"
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55 label="Data matrix"
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56 help="Block data in tabular format (rows = variables, columns = samples). The first column contains the variables names and the first row contains the samples names. Samples names must be in the same order for all blocks and the sample metadata (transposed). The data must not contain missing values." />
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57 <param name="variable_metadata" type="data" format="tabular" optional="true"
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58 label="Variables metadata [optional]"
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59 help="Variables metadata in tabular format (rows = variables). The first colum contains the variables names. The first row contains the metadata column names. The number of rows in the metadata file must be the same than the number of rows in the block data file, and the variables need to be in the same order. If a metadata file is provided, block.splsda output will be appended as new columns, otherwise a new file will be created." />
0
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60 </repeat>
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61 <param name="sample_metadata_in" type="data" format="tabular"
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62 label="Samples metadata"
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63 help="Samples metadata in tabular format (rows = samples). The first column contains the sample names. The first row contains the metadata column names. Samples names must be in the same order (transposed) than all the blocks. One of the column (the last by default) must contain the samples groups for integration." />
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64 <param name="sample_description_col" type="integer" value="0" min="0"
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65 label="Samples groups column number"
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66 help="Column from the samples metadata file containing samples groups. If set to 0, the last column will be used." />
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67 <param name="ncomp" type="integer" value="2" min="1"
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68 label="Number of components to include in the model"
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69 help="[ncomp] Number of new variables (components) computed by the data integration." />
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70 <param name="correlation" type="boolean" truevalue="--correlation"
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71 falsevalue="" checked="false"
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72 label="Correlation between all blocks"
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73 help="[design] If set to Yes, data integration will take into account correlations between all the blocks (design matrix with diagonal coefficients set to 0 and the rest of the coefficients set to 1)." />
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74 <section name="adv" title="Advanced Options" expanded="false">
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75 <!-- <param name="scheme" type="select" label="Scheme">
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76 <option value="horst" selected="true">horst</option>
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77 <option value="factorial" >factorial</option>
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78 <option value="centroid" >centroid</option>
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79 </param>
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80 <param name="mode" type="select" label="Mode">
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81 <option value="regression" selected="true">regression</option>
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82 <option value="canonical" >canonical</option>
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83 <option value="invariant" >invariant</option>
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84 <option value="classic" >classic</option>
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85 </param> -->
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86 <param name="maxiter" type="integer" value="100" min="1"
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87 label="Maximum number of iterations"
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88 help="[max.iter] Maximum number of iterations performed by block.splsda." />
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89 <!-- <param name="scale" type="boolean" truevalue="-\-scale" falsevalue="" checked="true"
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90 label="Scale"
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91 help="if checked, each block is standardized to zero means and unit variances" />
0
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92 <param name="init" type="select" label="Init">
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93 <option value="svd" selected="true">svd</option>
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94 <option value="svd.single" >svd.single</option>
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95 </param>
4
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96 <param name="tol" type="float" value="1e-06" min="0"
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97 label="Convergence stopping value"
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98 help="[tol]" />
5
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99 <param name="nearzerovar" type="boolean" truevalue="-\-nearzerovar" falsevalue="" checked="true"
4
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100 label="Should be set to TRUE in particular for data with many zero values" /> -->
0
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101 </section>
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102 </inputs>
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103
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104 <outputs>
1
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105 <data name="rdata_out" format="rdata" label="${tool.name}_output.rdata" />
4
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106 <data name="sample_metadata_out" format="tabular"
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107 label="${tool.name}_${sample_metadata_in.name}" />
1
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108 <collection name="blocks_output" type="list" label="${tool.name}_blocks_output">
4
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109 <discover_datasets pattern="(?P&lt;designation&gt;.+)\.tsv"
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110 directory="outdir" format="tabular" />
0
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111 </collection>
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112 </outputs>
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113
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114 <tests>
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115 <test>
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116 <repeat name="blocks">
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117 <param name="block_name" value="Block1" />
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118 <param name="data_matrix" value="in_block1_data.tabular" />
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119 </repeat>
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120 <repeat name="blocks">
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121 <param name="block_name" value="Block2" />
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122 <param name="data_matrix" value="in_block2_data.tabular" />
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123 </repeat>
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124 <param name="sample_metadata_in" value="in_sample_meta.tabular" />
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125 <output name="rdata_out" value="out_rdata.rdata" />
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126 <output name="sample_metadata_out" value="out_sample_meta.tabular" />
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127 </test>
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128 </tests>
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129
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130 <help>
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131 <![CDATA[
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132 .. class:: infomark
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133
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134 **Authors** Pierre Pericard (pierre.pericard@pasteur-lille.fr)
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135
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136 ---------------------------------------------------
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137
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138 .. class:: infomark
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139
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140 **Please cite**
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141
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142 Rohart F, Gautier B, Singh A, Lê Cao KA (2017) mixOmics: An R package for ‘omics feature selection and multiple data integration.
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143 PLOS Computational Biology 13(11): e1005752. https://doi.org/10.1371/journal.pcbi.1005752
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144
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145 ---------------------------------------------------
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146
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147 ======================
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148 mixOmics blocks.splsda
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149 ======================
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150
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151 -----------
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152 Description
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153 -----------
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154
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155 The blocks.splsda function is part of the mixOmics package for exploration and integration of Omics datasets.
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156 Performs N-integration and feature selection with Projection to Latent Structures models (PLS) with sparse Discriminant Analysis.
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157
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158 -----------
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159 Input files
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160 -----------
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161
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162 For each block (min 2 blocks):
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163 ==============================
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164
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165 +------------------------------+------------+
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166 | Parameter : num + label | Format |
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167 +==============================+============+
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168 | 1 : Data matrix | tabular |
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169 +------------------------------+------------+
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170 | 2 : [opt] Variables metadata | tabular |
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171 +------------------------------+------------+
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172
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173 Variables metadata files are optional.
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174 If a file is provided, output metadata will be appended to the input file, otherwise a new output file will be created.
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175
1
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176 1. Data matrix format
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177 * Rows = variables, Columns = samples
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178 * First row = samples name. MUST be the same and in the same order in every block as well as in the sample metadata file (transposed)
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179 * First column = variables name
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180
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181 2. Variables metadata format
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182 * Rows = variables, Columns = metadata
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183 * First row = metadata column names
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184 * First column = variables names. MUST be the same and in the same order than in the associated data matrix
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185
0
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186 Global input files:
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187 ===================
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188
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189 +-----------------------------+------------+
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190 | Parameter : num + label | Format |
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191 +=============================+============+
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192 | 1 : Samples metadata | tabular |
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193 +-----------------------------+------------+
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194
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195 By default, the last column of the samples metadata matrix will be used as samples description factors.
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196 If it's not the case, the column number can be inputed in the `Sample description column number` parameter.
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197
1
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198 1. Samples metadata format
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199 * Rows = samples, Columns = metadata
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200 * First row = metadata column names
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201 * First column = sample names. These names must be identical (transposed) and in the same order than for the blocks data matrices
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202
0
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203 ----------
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204 Parameters
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205 ----------
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206
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207 For each block (min 2 blocks):
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208 ==============================
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209
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210 Block name
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211 Name of the block. If not provided, this will default to the input filename
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212
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213 Number of variables to select for each component
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214 If set to 0 (default), all variables will be considered in the model
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215
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216 Global parameters:
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217 ==================
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218
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219 Sample description column number
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220
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221 Number of components to include in the model
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222
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223 Correlation between all blocks
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224
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225 Advanced options:
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226 =================
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227
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228 Scheme
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229
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230 Mode
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231
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232 Maximum number of iterations
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233
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234 Scale
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235
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236 Init
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237
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238 Convergence stopping value (tol)
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239
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240 Near zero var
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241
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242 ------------
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243 Output files
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244 ------------
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245
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246 mixomics_blocksplsda_output.rdata
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247 | rData output
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248 | Contains the `mixomics_result` R object containing the result of the block.splsda function
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249
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250 mixomics_blocksplsda_{input_sample_metadata_name}
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251 | tabular output
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252 | Identical to the input Sample metadata file with appended columns from the result of block.splsda function
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253
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254 mixomics_blocksplsda_blocks_output
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255 A collection with the variable metadata output files (mixomics_blocksplsda_block_{block name}_variable_metadata) for each input block
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256
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257 ]]>
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258 </help>
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259
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260 <citations>
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261 <citation type="doi">10.1371/journal.pcbi.1005752</citation>
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262 </citations>
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263
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264 </tool>