/************************************************************************* * * * 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.reachablesexplorer; import com.act.biointerpretation.l2expansion.sparkprojectors.utility.ProjectionResult; import com.fasterxml.jackson.annotation.JsonCreator; import com.fasterxml.jackson.annotation.JsonProperty; import com.mongodb.BasicDBList; import com.mongodb.BasicDBObject; import com.mongodb.DBCollection; import scala.collection.JavaConversions; import java.util.Arrays; import java.util.List; public class ReachablesProjectionUpdate { public static final String PRECURSOR_KEY = "prediction_precursors"; public static final String INCHI_KEY = "InChI"; public static final String SUBSTRATES_KEY = "substrates"; public static final String RO_KEY = "ro"; private static final Boolean UPSERT = true; private static final Boolean NO_MULTI = false; @JsonProperty("substrates") private final List<String> substrates; @JsonProperty("products") private final List<String> products; @JsonProperty("ros") private final List<String> ros; @JsonCreator public ReachablesProjectionUpdate( @JsonProperty("substrates") List<String> substrates, @JsonProperty("products") List<String> products, @JsonProperty("ros") List<String> ros) { this.substrates = substrates; this.products = products; this.ros = ros; } public ReachablesProjectionUpdate(ProjectionResult projectionResult) { this.ros = Arrays.asList(projectionResult.ros()); this.substrates = JavaConversions.asJavaList(projectionResult.substrates()); this.products = JavaConversions.asJavaList(projectionResult.products()); } public ReachablesProjectionUpdate(ReachablesProjectionResult projectionResult) { this.ros = Arrays.asList(projectionResult.getRos()); this.substrates = projectionResult.getSubstrates(); this.products = projectionResult.getProducts(); } public void updateDatabase(DBCollection reachables) { for (String product : products) { // The query object for this product BasicDBObject newProductQuery = new BasicDBObject().append(INCHI_KEY, product); // DB list of the substrates of this projection BasicDBList substrateList = new BasicDBList(); substrateList.addAll(substrates); // DB list of the one RO associated with this projection BasicDBList roList = new BasicDBList(); roList.addAll(ros); // The full entry to be added to the product's precursor list BasicDBObject precursorEntry = new BasicDBObject() .append(SUBSTRATES_KEY, substrateList) .append(RO_KEY, roList); // The command to push the precursor entry onto the precursor list BasicDBObject precursors = new BasicDBObject(); precursors.append("$push", new BasicDBObject(PRECURSOR_KEY, precursorEntry)); // Do the update! reachables.update(newProductQuery, precursors, UPSERT, NO_MULTI); } } public void updateByLoader(Loader loader){ loader.updateFromProjection(this); } /** * Get the products associated with this projection. This is especially needed since the Precursor data associated * with this ProjectionResult will need to be associated with every product of the projection. * @return The products of the projection. */ public List<String> getProducts() { return products; } public List<String> getSubstrates() { return substrates; } public List<String> getRos() { return ros; } }