/*
* Copyright (c) 2003-2012 Fred Hutchinson Cancer Research Center
*
* Licensed under the Apache License, Version 2.0 (the "License");
* you may not use this file except in compliance with the License.
* You may obtain a copy of the License at
*
* http://www.apache.org/licenses/LICENSE-2.0
*
* Unless required by applicable law or agreed to in writing, software
* distributed under the License is distributed on an "AS IS" BASIS,
* WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied.
* See the License for the specific language governing permissions and
* limitations under the License.
*/
package org.fhcrc.cpl.toolbox.chem;
/**
* Represents a simple chemical addition that can happen to an Adduct. Just adds the specified ChemicalFormula
* atoms to the Adduct. Does no checking to see if this is reasonable
*/
public class SimpleChemicalAddition implements ChemicalModification
{
protected ChemicalFormula formulaToAdd;
public SimpleChemicalAddition()
{
}
public SimpleChemicalAddition(ChemicalFormula formulaToAdd)
{
this.formulaToAdd = formulaToAdd;
}
/**
* Creates a new Adduct with the modification performed
* @param adduct
* @return
*/
public void perform(Adduct adduct)
{
adduct.setFormula(adduct.getFormula().createFormulaWithAddition(formulaToAdd));
adduct.modifications.add(this);
}
/**
* Assume we can always add stuff
* @param adduct
* @return
*/
public boolean canPerform(Adduct adduct)
{
return true;
}
public String getSymbol()
{
return "+" + formulaToAdd;
}
public String getName()
{
return "Addition of " + formulaToAdd;
}
}