Mercurial > repos > galaxyp > openms
diff MapRTTransformer.xml @ 0:3070d71e0e5c draft
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author | bgruening |
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date | Thu, 16 Apr 2015 08:37:04 -0400 |
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--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/MapRTTransformer.xml Thu Apr 16 08:37:04 2015 -0400 @@ -0,0 +1,142 @@ +<?xml version='1.0' encoding='UTF-8'?> +<tool id="MapRTTransformer" name="MapRTTransformer" version="2.0.0"> + <description>Applies retention time transformations to maps.</description> + <macros> + <token name="@EXECUTABLE@">MapRTTransformer</token> + <import>macros.xml</import> + </macros> + <expand macro="stdio"/> + <expand macro="requirements"/> + <command>MapRTTransformer + +-in + #for token in $param_in: + $token + #end for + +#if $rep_param_out: +-out + #for token in $rep_param_out: + #if " " in str(token): + "$token.param_out" + #else + $token.param_out + #end if + #end for +#end if +-trafo_in + #for token in $param_trafo_in: + $token + #end for + +#if $rep_param_trafo_out: +-trafo_out + #for token in $rep_param_trafo_out: + #if " " in str(token): + "$token.param_trafo_out" + #else + $token.param_trafo_out + #end if + #end for +#end if +#if $param_invert: + -invert +#end if +-threads \${GALAXY_SLOTS:-24} +#if $param_model_type: + -model:type + #if " " in str($param_model_type): + "$param_model_type" + #else + $param_model_type + #end if +#end if +#if $param_model_linear_symmetric_regression: + -model:linear:symmetric_regression +#end if +#if $param_model_b_spline_wavelength: + -model:b_spline:wavelength $param_model_b_spline_wavelength +#end if +#if $param_model_b_spline_num_nodes: + -model:b_spline:num_nodes $param_model_b_spline_num_nodes +#end if +#if $param_model_b_spline_extrapolate: + -model:b_spline:extrapolate + #if " " in str($param_model_b_spline_extrapolate): + "$param_model_b_spline_extrapolate" + #else + $param_model_b_spline_extrapolate + #end if +#end if +#if $param_model_b_spline_boundary_condition: + -model:b_spline:boundary_condition $param_model_b_spline_boundary_condition +#end if +#if $param_model_interpolated_interpolation_type: + -model:interpolated:interpolation_type + #if " " in str($param_model_interpolated_interpolation_type): + "$param_model_interpolated_interpolation_type" + #else + $param_model_interpolated_interpolation_type + #end if +#end if +#if $adv_opts.adv_opts_selector=='advanced': + #if $adv_opts.param_force: + -force +#end if +#end if +</command> + <inputs> + <param name="param_in" type="data" format="featurexml,consensusxml,mzml,idxml" multiple="true" optional="True" size="30" label="Input files to transform (separated by blanks)" help="(-in) "> + <sanitizer> + <valid initial="string.printable"> + <remove value="'"/> + <remove value="""/> + </valid> + </sanitizer> + </param> + <param name="param_trafo_in" type="data" format="trafoxml" multiple="true" optional="False" size="30" label="Transformations to apply (files separated by blanks)" help="(-trafo_in) "> + <sanitizer> + <valid initial="string.printable"> + <remove value="'"/> + <remove value="""/> + </valid> + </sanitizer> + </param> + <param name="param_invert" type="boolean" truevalue="-invert" falsevalue="" checked="false" optional="True" label="Invert transformations (approximatively) before applying them" help="(-invert) "/> + <param name="param_model_type" type="select" optional="True" value="none" label="Type of model" help="(-type) "> + <option value="none">none</option> + <option value="linear">linear</option> + <option value="b_spline">b_spline</option> + <option value="interpolated">interpolated</option> + </param> + <param name="param_model_linear_symmetric_regression" type="boolean" truevalue="-model:linear:symmetric_regression" falsevalue="" checked="false" optional="True" label="Perform linear regression on 'y - x' vs" help="(-symmetric_regression) 'y + x', instead of on 'y' vs. 'x'"/> + <param name="param_model_b_spline_wavelength" type="float" min="0.0" optional="True" value="0.0" label="Determines the amount of smoothing by setting the number of nodes for the B-spline" help="(-wavelength) The number is chosen so that the spline approximates a low-pass filter with this cutoff wavelength. The wavelength is given in the same units as the data; a higher value means more smoothing. '0' sets the number of nodes to twice the number of input points"/> + <param name="param_model_b_spline_num_nodes" type="integer" min="0" optional="True" value="5" label="Number of nodes for B-spline fitting" help="(-num_nodes) Overrides 'wavelength' if set (to two or greater). A lower value means more smoothing"/> + <param name="param_model_b_spline_extrapolate" type="select" optional="True" value="linear" label="Method to use for extrapolation beyond the original data range" help="(-extrapolate) 'linear': Linear extrapolation using the slope of the B-spline at the corresponding endpoint. 'b_spline': Use the B-spline (as for interpolation). 'constant': Use the constant value of the B-spline at the corresponding endpoint. 'global_linear': Use a linear fit through the data (which will most probably introduce discontinuities at the ends of the data range)"> + <option value="linear">linear</option> + <option value="b_spline">b_spline</option> + <option value="constant">constant</option> + <option value="global_linear">global_linear</option> + </param> + <param name="param_model_b_spline_boundary_condition" type="integer" min="0" max="2" optional="True" value="2" label="Boundary condition at B-spline endpoints: 0 (value zero), 1 (first derivative zero) or 2 (second derivative zero)" help="(-boundary_condition) "/> + <param name="param_model_interpolated_interpolation_type" type="select" optional="True" value="cspline" label="Type of interpolation to apply" help="(-interpolation_type) "> + <option value="linear">linear</option> + <option value="cspline">cspline</option> + <option value="akima">akima</option> + </param> + <expand macro="advanced_options"> + <param name="param_force" type="boolean" truevalue="-force" falsevalue="" checked="false" optional="True" label="Overwrite tool specific checks" help="(-force) "/> + </expand> + </inputs> + <outputs> + <data name="param_out" metadata_source="param_in" format="input"/> + <data name="param_trafo_out" format="trafoxml"/> + </outputs> + <help>**What it does** + +Applies retention time transformations to maps. + + +For more information, visit http://ftp.mi.fu-berlin.de/OpenMS/release-documentation/html/TOPP_MapRTTransformer.html</help> + <expand macro="references"/> +</tool>