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Module to parse HELM Notation in the format 1 and 2.
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/**
* *****************************************************************************
* Copyright C 2015, The Pistoia Alliance
*
* Permission is hereby granted, free of charge, to any person obtaining a copy
* of this software and associated documentation files (the "Software"), to deal
* in the Software without restriction, including without limitation the rights
* to use, copy, modify, merge, publish, distribute, sublicense, and/or sell
* copies of the Software, and to permit persons to whom the Software is
* furnished to do so, subject to the following conditions:
*
* The above copyright notice and this permission notice shall be included in
* all copies or substantial portions of the Software.
*
* THE SOFTWARE IS PROVIDED "AS IS", WITHOUT WARRANTY OF ANY KIND, EXPRESS OR
* IMPLIED, INCLUDING BUT NOT LIMITED TO THE WARRANTIES OF MERCHANTABILITY,
* FITNESS FOR A PARTICULAR PURPOSE AND NONINFRINGEMENT. IN NO EVENT SHALL THE
* AUTHORS OR COPYRIGHT HOLDERS BE LIABLE FOR ANY CLAIM, DAMAGES OR OTHER
* LIABILITY, WHETHER IN AN ACTION OF CONTRACT, TORT OR OTHERWISE, ARISING FROM,
* OUT OF OR IN CONNECTION WITH THE SOFTWARE OR THE USE OR OTHER DEALINGS IN THE
* SOFTWARE.
*****************************************************************************
*/
package org.helm.notation2.parser.notation.polymer;
import java.io.IOException;
import org.helm.notation2.parser.exceptionparser.HELM1ConverterException;
import org.helm.notation2.parser.exceptionparser.NotationException;
/**
* MonomerNotationUnit
*
* @author hecht
*/
public class MonomerNotationUnit extends MonomerNotation {
public MonomerNotationUnit() {
}
/**
* Constructs with the given String
*
* @param str Monomer
* @param type polymer type, e.g. RNA, Peptide or CHEM
* @throws NotationException if notation is not valid
*/
public MonomerNotationUnit(String str, String type) throws NotationException {
super(str, type);
}
/**
* {@inheritDoc}
*/
@Override
public String toHELM2() {
String text = unit;
if (isDefault == false) {
if (unit.length() > 1) {
text = "(" + unit + ")";
}
text += "'" + count + "'";
}
if (isAnnotationHere) {
text += "\"" + annotation + "\"";
}
return text;
}
@Override
public String toHELM() throws HELM1ConverterException {
String text = unit;
/* check for appropriate units */
if (!(isDefault)) {
if (unit.length() > 1) {
text = "(" + unit + ")";
}
}
if (unit.equals("X") || unit.contains("(N)")) {
throw new HELM1ConverterException("not possible to downgrade to HELM1 Format");
}
/*
* convert the count in an appropriate way: throw an exception if it is not
* an explicit integer value
*/
try {
int integerValue = Integer.parseInt(count);
if (integerValue < 1 || integerValue > 1) {
throw new HELM1ConverterException("Count of MonomerNotationUnit was not possible to downgrade");
}
// for (int i = 0; i < integer_value - 1; i++) {
// text += "." + unit;
// }
} catch (NumberFormatException e) {
throw new HELM1ConverterException("Count of MonomerNotationUnit was not possible to downgrade");
}
/* no annotation here!!! -> forget simple the annotation */
return text;
}
}