/* * Copyright 2006-2016 The MZmine 3 Development Team * * This file is part of MZmine 3. * * MZmine 3 is free software; you can redistribute it and/or modify it under the terms of the GNU * General Public License as published by the Free Software Foundation; either version 2 of the * License, or (at your option) any later version. * * MZmine 3 is distributed in the hope that it will be useful, but WITHOUT ANY WARRANTY; without * even the implied warranty of MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the GNU * General Public License for more details. * * You should have received a copy of the GNU General Public License along with MZmine 3; if not, * write to the Free Software Foundation, Inc., 51 Franklin St, Fifth Floor, Boston, MA 02110-1301 * USA */ package io.github.mzmine.modules.alignment.joinaligner; import io.github.msdk.util.tolerances.MaximumMzTolerance; import io.github.msdk.util.tolerances.RTTolerance; import io.github.mzmine.parameters.ParameterSet; import io.github.mzmine.parameters.ParameterValidator; import io.github.mzmine.parameters.parametertypes.BooleanParameter; import io.github.mzmine.parameters.parametertypes.IntegerParameter; import io.github.mzmine.parameters.parametertypes.StringParameter; import io.github.mzmine.parameters.parametertypes.selectors.FeatureTablesParameter; import io.github.mzmine.parameters.parametertypes.tolerances.MZToleranceParameter; import io.github.mzmine.parameters.parametertypes.tolerances.RTToleranceParameter; public class JoinAlignerParameters extends ParameterSet { public static final FeatureTablesParameter featureTables = new FeatureTablesParameter(); public static final MZToleranceParameter mzTolerance = new MZToleranceParameter("m/z tolerance", "Maximum allowed difference between two m/z values to be considered same.\n" + "The value is specified both as absolute tolerance (in m/z) and relative tolerance (in ppm).\n" + "The tolerance range is calculated using maximum of the absolute and relative tolerances.", "Algorithm Parameters", ParameterValidator.createNonEmptyValidator(), new MaximumMzTolerance(0.001, 5.0)); public static final RTToleranceParameter rtTolerance = new RTToleranceParameter("RT tolerance", "Maximum allowed retention time difference between two features.", "Algorithm Parameters", ParameterValidator.createNonEmptyValidator(), new RTTolerance(10, true)); public static final IntegerParameter mzWeight = new IntegerParameter("Weight for m/z", "Score for perfectly matching m/z values", "Algorithm Parameters", ParameterValidator.createNonEmptyValidator(), 100); public static final IntegerParameter rtWeight = new IntegerParameter("Weight for RT", "Score for perfectly matching retention time (RT) values", "Algorithm Parameters", ParameterValidator.createNonEmptyValidator(), 100); public static final BooleanParameter requireSameAnnotation = new BooleanParameter("Require same annotation?", "If checked, only features with the same annoation (or no annotation) will be aligned.", "Algorithm Parameters", false); public static final BooleanParameter requireSameCharge = new BooleanParameter( "Require same charge?", "If checked, only features with the same charge will be aligned.", "Algorithm Parameters", false); public static final StringParameter featureTableName = new StringParameter("Feature table name", "Name of the aligned feature table.", "Output", "Aligned Feature Table"); public static final BooleanParameter removeOldTable = new BooleanParameter("Remove original tables?", "If checked, the original feature tables will be removed.", "Output", false); /** * Create the parameter set. */ public JoinAlignerParameters() { super(featureTables, mzTolerance, rtTolerance, mzWeight, rtWeight, requireSameAnnotation, requireSameCharge, featureTableName, removeOldTable); } }