/*************************************************************************
* *
* This file is part of the 20n/act project. *
* 20n/act enables DNA prediction for synthetic biology/bioengineering. *
* Copyright (C) 2017 20n Labs, Inc. *
* *
* Please direct all queries to act@20n.com. *
* *
* This program 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 3 of the License, or *
* (at your option) any later version. *
* *
* This program 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 this program. If not, see <http://www.gnu.org/licenses/>. *
* *
*************************************************************************/
package act.installer.metacyc.entities;
import act.installer.metacyc.Resource;
import act.installer.metacyc.BPElement;
import act.installer.metacyc.NXT;
import act.installer.metacyc.OrganismComposition;
import act.installer.metacyc.JsonHelper;
import org.json.JSONObject;
import java.util.Set;
import java.util.HashSet;
public class SmallMoleculeRef extends BPElement {
Set<Resource> memberEntityRefs; // reference to other small molecules?
Resource chemicalStructure;
Float molecularWeight;
public Resource getChemicalStructure() { return this.chemicalStructure; }
public Float getMolecularWeight() { return this.molecularWeight; }
public SmallMoleculeRef(BPElement basics, Set<Resource> memRefs, Resource struc, Float molWeight) {
super(basics);
this.memberEntityRefs = memRefs;
this.chemicalStructure = struc;
this.molecularWeight = molWeight;
}
@Override
public Set<Resource> field(NXT typ) {
Set<Resource> s = new HashSet<Resource>();
if (typ == NXT.structure) {
s.add(this.chemicalStructure);
} else if (typ == NXT.members) {
s.addAll(this.memberEntityRefs);
}
return s;
}
public JSONObject expandedJSON(OrganismComposition src) {
JsonHelper o = new JsonHelper(src);
o.add("name", super.standardName); // from BPElement
if (memberEntityRefs != null)
for (BPElement mem : src.resolve(memberEntityRefs))
o.add("members", mem.expandedJSON(src));
if (molecularWeight != null)
o.add("mol_weight", molecularWeight);
if (chemicalStructure != null)
o.add("structure", src.resolve(chemicalStructure).expandedJSON(src));
return o.getJSON();
}
}