From 0829af5eb66d729729130beff7fb55b107b05353 Mon Sep 17 00:00:00 2001 From: jkiederle <jana.kiederle@fau.de> Date: Wed, 20 Apr 2022 18:15:56 +0200 Subject: [PATCH] add full version of eps and eps main file --- ...asetGeneOntologyInformationCollection.xlsx | Bin 0 -> 27779 bytes .../RNA_trees/RNA_trees_bracket/._PKB10 | Bin 0 -> 245 bytes .../RNA_trees/RNA_trees_bracket/._PKB100 | Bin 0 -> 245 bytes .../RNA_trees/RNA_trees_bracket/._PKB101 | Bin 0 -> 245 bytes .../RNA_trees/RNA_trees_bracket/._PKB102 | Bin 0 -> 245 bytes .../RNA_trees/RNA_trees_bracket/._PKB103 | Bin 0 -> 245 bytes .../RNA_trees/RNA_trees_bracket/._PKB104 | Bin 0 -> 245 bytes .../RNA_trees/RNA_trees_bracket/._PKB105 | Bin 0 -> 245 bytes .../RNA_trees/RNA_trees_bracket/._PKB106 | Bin 0 -> 245 bytes .../RNA_trees/RNA_trees_bracket/._PKB11 | Bin 0 -> 245 bytes .../RNA_trees/RNA_trees_bracket/._PKB119 | Bin 0 -> 245 bytes .../RNA_trees/RNA_trees_bracket/._PKB120 | Bin 0 -> 244 bytes .../RNA_trees/RNA_trees_bracket/._PKB128 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normalized_edge_preservation_sim_exact.csv} (100%) delete mode 100644 final_results_data/data/normalized_gurobi_dist.csv rename final_results_data/data/{treeEditDistanceResult.CSV => tree_edit_distance.csv} (100%) rename final_results_data/data/{df_tree_edit_similarity.csv => tree_edit_similarity.csv} (100%) rename final_results_data/results/{normalized_approx_gurobi_results.csv => normalized_edge_preservation_sim_results.csv} (100%) rename final_results_data/results/{not_normalized_approx_gurobi_results.csv => not_normalized_edge_preservation_sim_results.csv} (100%) rename final_results_data/results/{scalability_gurobi.png => scalability_edge_preservation_sim_exact.png} (100%) rename final_results_data/results/{scalability_approx.png => scalability_edge_preservation_similarity_approx.png} (100%) create mode 100644 notebooks_python/edge_preservation_similarity.py create mode 100644 notebooks_python/edge_preservation_similarity_main.py diff --git 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similarity index 100% rename from all_other_data/gml_data/PKB119/1.txt rename to all_other_data/RNA_trees/RNA_trees_gml/PKB119/1.txt diff --git a/all_other_data/gml_data/PKB120/1.txt b/all_other_data/RNA_trees/RNA_trees_gml/PKB120/1.txt similarity index 100% rename from all_other_data/gml_data/PKB120/1.txt rename to all_other_data/RNA_trees/RNA_trees_gml/PKB120/1.txt diff --git a/all_other_data/gml_data/PKB120/2.txt b/all_other_data/RNA_trees/RNA_trees_gml/PKB120/2.txt similarity index 100% rename from all_other_data/gml_data/PKB120/2.txt rename to all_other_data/RNA_trees/RNA_trees_gml/PKB120/2.txt diff --git a/all_other_data/gml_data/PKB128/1.txt b/all_other_data/RNA_trees/RNA_trees_gml/PKB128/1.txt similarity index 100% rename from all_other_data/gml_data/PKB128/1.txt rename to all_other_data/RNA_trees/RNA_trees_gml/PKB128/1.txt diff --git a/all_other_data/gml_data/PKB13/1.txt b/all_other_data/RNA_trees/RNA_trees_gml/PKB13/1.txt similarity index 100% rename from all_other_data/gml_data/PKB13/1.txt rename to all_other_data/RNA_trees/RNA_trees_gml/PKB13/1.txt diff --git a/all_other_data/gml_data/PKB130/1.txt b/all_other_data/RNA_trees/RNA_trees_gml/PKB130/1.txt similarity index 100% rename from all_other_data/gml_data/PKB130/1.txt rename to all_other_data/RNA_trees/RNA_trees_gml/PKB130/1.txt diff --git a/all_other_data/gml_data/PKB130/2.txt b/all_other_data/RNA_trees/RNA_trees_gml/PKB130/2.txt similarity index 100% rename from all_other_data/gml_data/PKB130/2.txt rename to all_other_data/RNA_trees/RNA_trees_gml/PKB130/2.txt diff --git a/all_other_data/gml_data/PKB135/1.txt b/all_other_data/RNA_trees/RNA_trees_gml/PKB135/1.txt similarity index 100% rename from all_other_data/gml_data/PKB135/1.txt rename to all_other_data/RNA_trees/RNA_trees_gml/PKB135/1.txt diff --git a/all_other_data/gml_data/PKB135/2.txt b/all_other_data/RNA_trees/RNA_trees_gml/PKB135/2.txt similarity index 100% rename from all_other_data/gml_data/PKB135/2.txt rename to 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b/all_other_data/RNA_trees/RNA_trees_gml/PKB6/1.txt similarity index 100% rename from all_other_data/gml_data/PKB6/1.txt rename to all_other_data/RNA_trees/RNA_trees_gml/PKB6/1.txt diff --git a/all_other_data/gml_data/PKB67/1.txt b/all_other_data/RNA_trees/RNA_trees_gml/PKB67/1.txt similarity index 100% rename from all_other_data/gml_data/PKB67/1.txt rename to all_other_data/RNA_trees/RNA_trees_gml/PKB67/1.txt diff --git a/all_other_data/gml_data/PKB68/1.txt b/all_other_data/RNA_trees/RNA_trees_gml/PKB68/1.txt similarity index 100% rename from all_other_data/gml_data/PKB68/1.txt rename to all_other_data/RNA_trees/RNA_trees_gml/PKB68/1.txt diff --git a/all_other_data/gml_data/PKB69/1.txt b/all_other_data/RNA_trees/RNA_trees_gml/PKB69/1.txt similarity index 100% rename from all_other_data/gml_data/PKB69/1.txt rename to all_other_data/RNA_trees/RNA_trees_gml/PKB69/1.txt diff --git a/all_other_data/gml_data/PKB7/1.txt b/all_other_data/RNA_trees/RNA_trees_gml/PKB7/1.txt similarity index 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all_other_data/RNA_trees/RNA_trees_gml/PKB77/2.txt diff --git a/all_other_data/gml_data/PKB79/1.txt b/all_other_data/RNA_trees/RNA_trees_gml/PKB79/1.txt similarity index 100% rename from all_other_data/gml_data/PKB79/1.txt rename to all_other_data/RNA_trees/RNA_trees_gml/PKB79/1.txt diff --git a/all_other_data/gml_data/PKB8/1.txt b/all_other_data/RNA_trees/RNA_trees_gml/PKB8/1.txt similarity index 100% rename from all_other_data/gml_data/PKB8/1.txt rename to all_other_data/RNA_trees/RNA_trees_gml/PKB8/1.txt diff --git a/all_other_data/gml_data/PKB89/1.txt b/all_other_data/RNA_trees/RNA_trees_gml/PKB89/1.txt similarity index 100% rename from all_other_data/gml_data/PKB89/1.txt rename to all_other_data/RNA_trees/RNA_trees_gml/PKB89/1.txt diff --git a/all_other_data/gml_data/PKB89/2.txt b/all_other_data/RNA_trees/RNA_trees_gml/PKB89/2.txt similarity index 100% rename from all_other_data/gml_data/PKB89/2.txt rename to all_other_data/RNA_trees/RNA_trees_gml/PKB89/2.txt diff --git a/all_other_data/gml_data/PKB9/1.txt b/all_other_data/RNA_trees/RNA_trees_gml/PKB9/1.txt similarity index 100% rename from all_other_data/gml_data/PKB9/1.txt rename to all_other_data/RNA_trees/RNA_trees_gml/PKB9/1.txt diff --git a/all_other_data/gml_data/PKB90/1.txt b/all_other_data/RNA_trees/RNA_trees_gml/PKB90/1.txt similarity index 100% rename from all_other_data/gml_data/PKB90/1.txt rename to all_other_data/RNA_trees/RNA_trees_gml/PKB90/1.txt diff --git a/all_other_data/gml_data/PKB91/1.txt b/all_other_data/RNA_trees/RNA_trees_gml/PKB91/1.txt similarity index 100% rename from all_other_data/gml_data/PKB91/1.txt rename to all_other_data/RNA_trees/RNA_trees_gml/PKB91/1.txt diff --git a/all_other_data/gml_data/PKB91/2.txt b/all_other_data/RNA_trees/RNA_trees_gml/PKB91/2.txt similarity index 100% rename from all_other_data/gml_data/PKB91/2.txt rename to all_other_data/RNA_trees/RNA_trees_gml/PKB91/2.txt diff --git a/all_other_data/gml_data/PKB98/1.txt b/all_other_data/RNA_trees/RNA_trees_gml/PKB98/1.txt similarity index 100% rename from all_other_data/gml_data/PKB98/1.txt rename to all_other_data/RNA_trees/RNA_trees_gml/PKB98/1.txt diff --git a/all_other_data/df_duos_approx_entire.csv b/all_other_data/df_duos_approx_entire.csv deleted file mode 100644 index 8538b9b..0000000 --- a/all_other_data/df_duos_approx_entire.csv +++ /dev/null @@ -1,73 +0,0 @@ -,PKB69,PKB206,PKB51,PKB106,PKB48,PKB98,PKB14,PKB130,PKB233,PKB42,PKB6,PKB4,PKB179,PKB46,PKB161,PKB20,PKB105,PKB70,PKB24,PKB91,PKB68,PKB159,PKB7,PKB77,PKB10,PKB8,PKB240,PKB103,PKB89,PKB137,PKB52,PKB248,PKB49,PKB32,PKB241,PKB128,PKB22,PKB50,PKB140,PKB43,PKB67,PKB79,PKB247,PKB16,PKB180,PKB177,PKB172,PKB136,PKB207,PKB119,PKB218,PKB38,PKB104,PKB15,PKB11,PKB171,PKB162,PKB242,PKB120,PKB158,PKB101,PKB142,PKB102,PKB100,PKB44,PKB135,PKB191,PKB13,PKB9,PKB160,PKB90,PKB236 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b/all_other_data/fixed_df_matrix_approx.csv deleted file mode 100644 index ca4171a..0000000 --- a/all_other_data/fixed_df_matrix_approx.csv +++ /dev/null @@ -1,11 +0,0 @@ -,PKB14,PKB42,PKB48,PKB51,PKB69,PKB98,PKB106,PKB130,PKB206,PKB233 -PKB14,32.0,14.0,17.0,18.0,19.0,20.0,20.0,17.0,15.0,20.0 -PKB42,14.0,31.0,19.0,20.0,19.0,16.0,22.0,18.0,13.0,22.0 -PKB48,17.0,19.0,60.0,24.0,26.0,34.0,26.0,20.0,20.0,32.0 -PKB51,18.0,20.0,24.0,48.0,23.0,21.0,27.0,18.0,18.0,26.0 -PKB69,19.0,19.0,26.0,23.0,53.0,25.0,28.0,20.0,16.0,29.0 -PKB98,20.0,16.0,34.0,21.0,25.0,51.0,27.0,19.0,23.0,28.0 -PKB106,20.0,22.0,26.0,27.0,28.0,27.0,52.0,18.0,20.0,30.0 -PKB130,17.0,18.0,20.0,18.0,20.0,19.0,18.0,35.0,13.0,21.0 -PKB206,15.0,13.0,20.0,18.0,16.0,23.0,20.0,13.0,37.0,21.0 -PKB233,20.0,22.0,32.0,26.0,29.0,28.0,30.0,21.0,21.0,56.0 diff --git a/all_other_data/fixed_df_matrix_gurobi.csv b/all_other_data/fixed_df_matrix_gurobi.csv deleted file mode 100644 index 3037567..0000000 --- a/all_other_data/fixed_df_matrix_gurobi.csv +++ /dev/null @@ -1,11 +0,0 @@ -,PKB14,PKB42,PKB48,PKB51,PKB69,PKB98,PKB106,PKB130,PKB206,PKB233 -PKB14,49.0,22.0,30.0,27.0,29.0,31.0,27.0,23.0,21.0,29.0 -PKB42,22.0,46.0,29.0,27.0,28.0,26.0,29.0,26.0,18.0,33.0 -PKB48,30.0,29.0,75.0,37.0,39.0,50.0,39.0,31.0,33.0,45.0 -PKB51,27.0,27.0,37.0,60.0,39.0,32.0,37.0,27.0,30.0,39.0 -PKB69,29.0,28.0,39.0,39.0,77.0,38.0,42.0,29.0,30.0,41.0 -PKB98,31.0,26.0,50.0,32.0,38.0,77.0,38.0,29.0,33.0,46.0 -PKB106,27.0,29.0,39.0,37.0,42.0,38.0,75.0,29.0,30.0,48.0 -PKB130,23.0,26.0,31.0,27.0,29.0,29.0,29.0,48.0,21.0,29.0 -PKB206,21.0,18.0,33.0,30.0,30.0,33.0,30.0,21.0,56.0,32.0 -PKB233,29.0,33.0,45.0,39.0,41.0,46.0,48.0,29.0,32.0,90.0 diff --git a/all_other_data/gurobi_df_dist.csv b/all_other_data/gurobi_df_dist.csv deleted file mode 100644 index 0a00a64..0000000 --- a/all_other_data/gurobi_df_dist.csv +++ /dev/null @@ -1,73 +0,0 @@ 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diff --git a/final_results_data/data/normalized_approx.csv b/final_results_data/data/normalized_edge_preservation_sim_approx.csv similarity index 100% rename from final_results_data/data/normalized_approx.csv rename to final_results_data/data/normalized_edge_preservation_sim_approx.csv diff --git a/final_results_data/data/normalized_gurobi.csv b/final_results_data/data/normalized_edge_preservation_sim_exact.csv similarity index 100% rename from final_results_data/data/normalized_gurobi.csv rename to final_results_data/data/normalized_edge_preservation_sim_exact.csv diff --git a/final_results_data/data/normalized_gurobi_dist.csv b/final_results_data/data/normalized_gurobi_dist.csv deleted file mode 100644 index a909141..0000000 --- a/final_results_data/data/normalized_gurobi_dist.csv +++ /dev/null @@ -1,73 +0,0 @@ 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diff --git a/final_results_data/data/treeEditDistanceResult.CSV b/final_results_data/data/tree_edit_distance.csv similarity index 100% rename from final_results_data/data/treeEditDistanceResult.CSV rename to final_results_data/data/tree_edit_distance.csv diff --git a/final_results_data/data/df_tree_edit_similarity.csv b/final_results_data/data/tree_edit_similarity.csv similarity index 100% rename from final_results_data/data/df_tree_edit_similarity.csv rename to final_results_data/data/tree_edit_similarity.csv diff --git a/final_results_data/results/normalized_approx_gurobi_results.csv b/final_results_data/results/normalized_edge_preservation_sim_results.csv similarity index 100% rename from final_results_data/results/normalized_approx_gurobi_results.csv rename to final_results_data/results/normalized_edge_preservation_sim_results.csv diff --git a/final_results_data/results/not_normalized_approx_gurobi_results.csv b/final_results_data/results/not_normalized_edge_preservation_sim_results.csv similarity index 100% rename from final_results_data/results/not_normalized_approx_gurobi_results.csv rename to final_results_data/results/not_normalized_edge_preservation_sim_results.csv diff --git a/final_results_data/results/scalability_gurobi.png b/final_results_data/results/scalability_edge_preservation_sim_exact.png similarity index 100% rename from final_results_data/results/scalability_gurobi.png rename to final_results_data/results/scalability_edge_preservation_sim_exact.png diff --git a/final_results_data/results/scalability_approx.png b/final_results_data/results/scalability_edge_preservation_similarity_approx.png similarity index 100% rename from final_results_data/results/scalability_approx.png rename to final_results_data/results/scalability_edge_preservation_similarity_approx.png diff --git a/notebooks_python/comparison_matrices_eval.ipynb b/notebooks_python/comparison_matrices_eval.ipynb index 6f03582..08c1e74 100644 --- a/notebooks_python/comparison_matrices_eval.ipynb +++ b/notebooks_python/comparison_matrices_eval.ipynb @@ -1975,17 +1975,93 @@ }, { "cell_type": "code", - "execution_count": 54, + "execution_count": 3, "metadata": {}, "outputs": [], - "source": [] + "source": [ + "def import_graph_coll(path):\n", + " '''reads in gml data and returns a list of lists of graphs''' \n", + " graph_coll=[]\n", + " listdir=os.listdir(path)\n", + " for dire in listdir:\n", + " graph_coll.append([])\n", + " graphdir=os.listdir(path+'/'+dire)\n", + " for graph_file in graphdir:\n", + " graph_coll[-1].append(nx.readwrite.gml.read_gml(path+'/'+dire+'/'+graph_file,label='id'))\n", + " return graph_coll" + ] }, { "cell_type": "code", - "execution_count": null, + "execution_count": 5, "metadata": {}, "outputs": [], - "source": [] + "source": [ + "path = \"/home/jana/Documents/BIONETs/Code/tree_match_approx_validator/all_other_data/RNA_trees/RNA_trees_gml\"\n", + "graph_coll = import_graph_coll(path)" + ] + }, + { + "cell_type": "code", + "execution_count": 14, + "metadata": {}, + "outputs": [], + "source": [ + "orders = []\n", + "for graph in graph_coll:\n", + " for g in graph:\n", + " o = g.order()\n", + " orders.append(o)" + ] + }, + { + "cell_type": "code", + "execution_count": 16, + "metadata": {}, + "outputs": [ + { + "data": { + "text/plain": [ + "113" + ] + }, + "execution_count": 16, + "metadata": {}, + "output_type": "execute_result" + } + ], + "source": [ + "len(orders)" + ] + }, + { + "cell_type": "code", + "execution_count": 17, + "metadata": {}, + "outputs": [], + "source": [ + "np_order = np.array(orders)" + ] + }, + { + "cell_type": "code", + "execution_count": 20, + "metadata": {}, + "outputs": [ + { + "data": { + "text/plain": [ + "52.0" + ] + }, + "execution_count": 20, + "metadata": {}, + "output_type": "execute_result" + } + ], + "source": [ + "np.median(np_order)" + ] }, { "cell_type": "code", diff --git a/notebooks_python/edge_preservation_similarity.py b/notebooks_python/edge_preservation_similarity.py new file mode 100644 index 0000000..8873617 --- /dev/null +++ b/notebooks_python/edge_preservation_similarity.py @@ -0,0 +1,321 @@ +#!/usr/bin/env python3 +# -*- coding: utf-8 -*- +""" +Created on Wed Jul 14 18:20:28 2021, edited Apr 2022 + +@authors: nboria, jkiederle +""" + +import gurobipy as gu +import os +import networkx as nx +import numpy as np + + + +def intersection(lst1, lst2): + lst3 = [value for value in lst1 if value in lst2] + return lst3 + +class Evaluator: + '''an instance of this is needed to compute the final result of the edge preservation similarity''' + + def __init__(self): + self._preserved_duos_G1=[] + self._preserved_duos_G2=[] + self._evaluation=0 + return None + + + def evaluate_sol(self,G1,G2,sol): + '''use this to get the egde preservation similarity computed (either approx or exact)''' + self._preserved_duos_G1=[] + self._preserved_duos_G2=[] + self._evaluation=0 + matched_G1=[m[0] for m in sol] + #print('matched_G1',matched_G1) + matched_G2=[m[1]-G1.order() for m in sol] + #print('matched_G2',matched_G2) + edges_G1=list(G1.edges) + edges_G2=list(G2.edges) + #print(edges_G1) + for i in range(len(matched_G1)): + for j in range(len(matched_G1)): + if (matched_G1[i],matched_G1[j]) in edges_G1: + if (matched_G2[i],matched_G2[j]) in edges_G2: + self._evaluation+=1 + self._preserved_duos_G1.append([matched_G1[i],matched_G1[j]]) + self._preserved_duos_G2.append([matched_G2[i],matched_G2[j]]) + return self._evaluation + +class Gurobi_solver: + '''an instance of this is needed to exactly compute the edge preservation similarity''' + + def __init__(self,verbose=None): + self._name='EDGE-PRESERVATION-SIM-EXACT' + self._sol=None + self._verbose=verbose + if self._verbose is None: + self._verbose=False + self._preserved_duos_G1=[] + + def compute_duos(self,G1,G2,timelimit=0): + '''this function is called to construct the matching(preserved duos) between graphs G1 and G2 + It always needs to be called before evaluating it with the Evaluator to get a result''' + + self._preserved_duos_G1=[] + self._sol=[] + m=gu.Model('distance') + m.setParam('OutputFlag', self._verbose) + if timelimit > 0: + m.setParam("TimeLimit", timelimit) + + #VARIABLES + x = {} + # xij = mapping node i to node j + for i in range(G1.order()): + for j in range(G2.order()): + x[i, j] = m.addVar(vtype=gu.GRB.BINARY) + y = {} + # yij =1 if duo ij is saved else 0 + for edge in list(G1.edges): + y[edge[0],edge[1]]=m.addVar(vtype=gu.GRB.BINARY) + + m.update() + + #CONSTRAINTS + + for i in range(G1.order()): + for j in range(G2.order()): + if G1.nodes[i]['lbl']!= G2.nodes[j]['lbl']: + m.addConstr(x[i, j]==0) + for i in range(G1.order()): + m.addConstr(gu.quicksum(x[i,j] for j in range(G2.order()))<=1) + for j in range(G2.order()): + m.addConstr(gu.quicksum(x[i,j] for i in range(G1.order()))<=1) + for edge1 in list(G1.edges): + m.addConstr(y[edge1[0],edge1[1]]<=gu.quicksum(x[edge1[0],edge2[0]]*x[edge1[1],edge2[1]] for edge2 in list(G2.edges))) + + #OBJECTIVE + m.setObjective(gu.quicksum(y[edge[0],edge[1]] for edge in list(G1.edges)), gu.GRB.MAXIMIZE) + + m.optimize() + self._sol=[] + for i in range(G1.order()): + for j in range(G2.order()): + if x[i,j].X>=0.99999: + self._sol.append([i,j+G1.order()]) + + for edge in list(G1.edges): + if y[edge[0],edge[1]].X>=0.99999: + self._preserved_duos_G1.append([edge[0],edge[1]]) + + if m.status == 9: + #time limit reached + print(m.status) + return True + return False + +class Approx_alg: + '''an instance of this is needed to approximately compute the edge preservation similarity''' + + def __init__(self): + self._name='EDGE-PRESERVATION-SIM-APPROX' + return None + + def compute_duos(self,G1,G2): + '''this function is called to construct the matching(preserved duos) between graphs G1 and G2 + It always needs to be called before evaluating it with the Evaluator to get a result''' + + self.init_match(G1,G2) + self.complete_Sols(G1,G2) + self._best_eval=0 + E=Evaluator() + for sol in self._sols: + if E.evaluate_sol(G1,G2,sol)>= self._best_eval: + self._best_eval=E._evaluation + self._sol=sol + + def matching_solver(self,G1,G2,LMG): + #reindexing nodes + edges=list(LMG.edges()) + weights=[] + for i,edge in enumerate(edges): + weights.append(LMG[edge[0]][edge[1]]['weight']) + edges[i]=sorted(edge) + list_indices_G1=[] + list_indices_G2=[] + for node in LMG.nodes: + if node < G1.order(): + list_indices_G1.append(node) + else: + list_indices_G2.append(node) + m=gu.Model() + m.setParam('OutputFlag', 0) + x={} + for i in list_indices_G1: + for j in list_indices_G2: + x[i,j]=m.addVar() + m.update() + for i in list_indices_G1: + m.addConstr(gu.quicksum(x[i,j] for j in list_indices_G2)<=1) + for j in list_indices_G2: + m.addConstr(gu.quicksum(x[i,j] for i in list_indices_G1)<=1) + + m.setObjective(gu.quicksum(x[e[0],e[1]]*weights[i] for i,e in enumerate(edges)), gu.GRB.MAXIMIZE) + m.optimize() + sol=[] + for e in edges: + if x[e[0],e[1]].X >= 0.9999 : + sol.append([e[0],e[1]]) + return sol + + + + def edge_weight(self,G1,v1_id,G2,v2_id): + '''weight of edge, number of duos that can be preserved locally by mapping V_g1 and V_g2''' + labels_G1 = self._labels_G1 + labels_G2 = self._labels_G2 + if labels_G1[v1_id]!=labels_G2[v2_id]: + return 0 + all_attr=self._all_attr + num_child_by_attr_v1=np.zeros((len(all_attr))) + num_child_by_attr_v2=np.zeros((len(all_attr))) + for child in G1.neighbors(v1_id): + for i in range(len(all_attr)): + if labels_G1[child]==all_attr[i]: + num_child_by_attr_v1[i]+=1 + for child in G2.neighbors(v2_id): + for i in range(len(all_attr)): + if labels_G2[child]==all_attr[i]: + num_child_by_attr_v2[i]+=1 + score=0.00001 + for i in range(len(all_attr)): + score+=min([num_child_by_attr_v1[i],num_child_by_attr_v2[i]]) + return score + + def create_LM_graph(self,G1,G2): + '''creates a Local Match (LM)-Graph, a weighted bipartite graph containing all vertices of G1 and G2 + only having edges between V_g1 and V-g2 that share the same label + label: weight of edge, number of duos that can be preserved locally by mapping V_g1 and V_g2 + preserved duo: child nodes of V_g2 and V_g2 match''' + self._labels_G1 = nx.get_node_attributes(G1, "lbl") + self._labels_G2 = nx.get_node_attributes(G2, "lbl") + self._all_attr=list(set(list(nx.get_node_attributes(G1,'lbl').values()) +list(nx.get_node_attributes(G2,'lbl').values()))) + indices_G1=list(range(G1.order())) + indices_G2=list(range(G1.order(),G1.order()+G2.order())) + LMG=nx.Graph() + LMG.add_nodes_from(indices_G1) + LMG.add_nodes_from(indices_G2) + for v in range(G1.order()): + LMG.nodes[v]['depth']=G1.nodes[v]['depth'] + for v in range(G2.order()): + LMG.nodes[indices_G2[v]]['depth']=G2.nodes[v]['depth'] + for v1 in range(G1.order()): + for v2 in range(G2.order()): + LMG.add_edge(v1,indices_G2[v2],weight=self.edge_weight(G1,v1,G2,v2)) + return LMG + + def complete_Sols(self,G1,G2): + '''optimizes mapping + before this method: similarity of father to child nodes relevant + after: similarity also to incoporate child nodes of child nodes''' + Sols=self._sols + indices_G1=list(range(G1.order())) + indices_G2=list(range(G1.order(),G1.order()+G2.order())) + for s,Sol in enumerate(Sols): + unmatched=indices_G1+indices_G2 + matched=[] + for edge in Sol: + matched.append(edge[0]) + matched.append(edge[1]) + unmatched.remove(edge[0]) + unmatched.remove(edge[1]) + RG=nx.Graph() + RG.add_nodes_from(unmatched) + for v1 in intersection(indices_G1,unmatched): + for v2 in intersection(indices_G2,unmatched): + if G1.nodes[v1]['lbl']!=G2.nodes[v2-G1.order()]['lbl']: + edge_weight=0 + else: + edge_weight=0.000001 + if len(list(G1.predecessors(v1)))==len(list(G2.predecessors(v2-G1.order())))==1: + f_v1=list(G1.predecessors(v1))[0] + f_v2=list(G2.predecessors(v2-G1.order()))[0] + if [f_v1,indices_G2[f_v2]] in Sol: + edge_weight+=1 + matched_sons_v1=intersection(matched,G1.neighbors(v1)) + matched_sons_v2=intersection(matched,G2.neighbors(v2-G1.order())) + for s_v1 in matched_sons_v1: + for s_v2 in matched_sons_v2: + if [s_v1,indices_G2[s_v2]] in Sol: + edge_weight+=1 + RG.add_edge(v1,v2,weight=edge_weight) + #sol_add=list(nx.max_weight_matching(RG)) + sol_add=self.matching_solver(G1,G2,RG) + for i,match in enumerate(sol_add): + sol_add[i]=sorted(match) + Sols[s]=Sol+sol_add + self._sols=Sols + + + def init_match(self,G1,G2): + LMG=self.create_LM_graph(G1,G2) + #indices_G1=list(range(G1.order())) + #indices_G2=list(range(G1.order(),G1.order()+G2.order())) + V1_even=[] + V1_odd=[] + V2_even=[] + V2_odd=[] + for i,node in enumerate(LMG.nodes): + if LMG.nodes[node]['depth']%2==0: + if i<G1.order(): + V1_even.append(i) + else: + V2_even.append(i) + elif i<G1.order(): + V1_odd.append(i) + else: + V2_odd.append(i) + Vs=[] + Vs.append(V1_even+V2_even) + Vs.append(V1_even+V2_odd) + Vs.append(V1_odd+V2_even) + Vs.append(V1_odd+V2_odd) + Sols=[] + for V in Vs: + LMG_temp=LMG.subgraph(V) + #sol=list(nx.max_weight_matching(LMG_temp)) + sol=self.matching_solver(G1,G2,LMG_temp) + for i,match in enumerate(sol): + sol[i]=sorted(match) + Sols.append(sol) + self._sols=Sols + + + +def import_graph_coll(path): + '''reads in gml data and returns a list of lists of graphs''' + graph_coll=[] + listdir=os.listdir(path) + for dire in listdir: + graph_coll.append([]) + graphdir=os.listdir(path+'/'+dire) + for graph_file in graphdir: + graph_coll[-1].append(nx.readwrite.gml.read_gml(path+'/'+dire+'/'+graph_file,label='id')) + return graph_coll + +def graph_coll_edit(coll): + '''adds depth data to each vertex in the collection''' + for mR in coll: + for G in mR: + for node in G.nodes: + SP=nx.shortest_path_length(G,0) + G.nodes[node]['depth']=SP[node] + return coll + + +def import_graph_names(path): + '''returns a list of names of graphs''' + listdir=os.listdir(path) + return listdir diff --git a/notebooks_python/edge_preservation_similarity_main.py b/notebooks_python/edge_preservation_similarity_main.py new file mode 100644 index 0000000..3d3419b --- /dev/null +++ b/notebooks_python/edge_preservation_similarity_main.py @@ -0,0 +1,295 @@ +""" +Created on Apr 2022 + +@authors: jkiederle +""" + + +import os +import numpy as np +import time +from datetime import date, datetime +import pandas as pd +from edge_preservation_similarity import * + + +def compute_algorithm_helper_fast(algorithm, graph_coll, duos, times, time_limit_reached, time_limit_exact, normalize=False): + '''FUNCTION FOR DIRECT USE, IF NICE RESULTS WANTED USE compute_algorithm(), SEE BELOW + computes the given algorithm and returns similarity/distance values, runtime and whether a timelimit was reached + note: fast means only one half of the matrix is computed and copied to other half (only important for APPROX) + + input: algorithm: possibilities: 'EDGE-PRESERVATION-SIM-APPROX' for approximation + 'EDGE-PRESERVATION-SIM-EXACT' for exact measure + graph_coll: graph collection + duos: empty matrix in which similarity or distance measure results are returned + times: empty matrix in which runtimes of algorithm are returned + time_limit_reached: empty matrix in which true/false are returned whether time limit was reached + time_limit_exact: time limit in seconds, note: only implemented for 'EDGE-PRESERVATION-SIM-EXACT' as it is NP-hard + normalize: flag, if true results are normalized by division by max(#edges in trees G1 or G2) + output: duos, times, time_limit_reached - all matrices defined above''' + + for i in range(len(graph_coll)): + for j in range(len(graph_coll)): + + # check whether you are at a position that needs computation (no computation below diagonal of matrix) + + if i <= j: + + G1=graph_coll[i][0] + G2=graph_coll[j][0] + value = 0.0 + + # compute value with algorithm + + tic=time.time() + + timeflag = False + if algorithm == 'EDGE-PRESERVATION-SIM-EXACT': + timeflag = GU.compute_duos(G1,G2, time_limit_exact) + print(timeflag) + + elif algorithm == 'EDGE-PRESERVATION-SIM-APPROX': + ALG.compute_duos(G1,G2) + + tac=time.time() + + # if time limit is reached put 0.0 and put True in time limit matrix + # else put false in time limit matrix (is already by default false) + + if timeflag: + duos[i][j] = 0.0 + times[i][j] = 0.0 + time_limit_reached[i][j] = True + time_limit_reached[j][i] = True + else: + times[i][j]=tac-tic + times[j][i]=tac-tic + + print("Duration ", tac-tic) + + + if algorithm == 'EDGE-PRESERVATION-SIM-EXACT': + value = E.evaluate_sol(G1,G2,GU._sol) + elif algorithm == 'EDGE-PRESERVATION-SIM-APPROX': + value = E.evaluate_sol(G1,G2,ALG._sol) + + if normalize: + value = normalize_value(value, G1, G2) + + duos[i][j] = value + duos[j][i] = value + + + return duos, times, time_limit_reached + + +def compute_algorithm_helper_exact(algorithm, graph_coll, duos, times, time_limit_reached, time_limit_exact=0, normalize=False): + '''FUNCTION FOR DIRECT USE, IF NICE RESULTS WANTED USE compute_algorithm(), SEE BELOW + computes the given algorithm and returns similarity/distance values, runtime and whether a timelimit was reached + note: exact means the entire matrix is computed. Symmetry is achieved by maximizing over the respective entries + more information see below (only important for APPROX) + + input: algorithm: possibilities 'EDGE-PRESERVATION-SIM-APPROX' for approximation + 'EDGE-PRESERVATION-SIM-EXACT' for exact measure + graph_coll: graph collection + duos: empty matrix in which similarity or distance measure results are returned + times: empty matrix in which runtimes of algorithm are returned + time_limit_reached: empty matrix in which true/false are returned whether time limit was reached + time_limit_exact: time limit in seconds, note: only implemented for 'EDGE-PRESERVATION-SIM-EXACT' as it is NP-hard + normalize: flag, if true results are normalized by division by max(#edges in trees G1 or G2) + output: duos, times, time_limit_reached - all matrices defined above''' + + for i in range(len(graph_coll)): + for j in range(len(graph_coll)): + + # compute all positions + + G1=graph_coll[i][0] + G2=graph_coll[j][0] + + # compute value with algorithm + # if time limit is reached put 0.0 and put True in time limit matrix + # else put false in time limit matrix (is already by default false) + #note: time limit only possible for 'EDGE-PRESERVATION-SIM-EXACT' + + tic=time.time() + + timeflag = False + if algorithm == 'EDGE-PRESERVATION-SIM-EXACT': + timeflag = GU.compute_duos(G1,G2, time_limit_exact) + print(timeflag) + + elif algorithm == 'EDGE-PRESERVATION-SIM-APPROX': + ALG.compute_duos(G1,G2) + + tac=time.time() + + if timeflag: + duos[i][j] = 0.0 + times[i][j] = 0.0 + time_limit_reached[i][j] = True + else: + times[i][j] = tac-tic + + print("Duration ", tac-tic) + + #final computation of the edge preservation similarity matrix based on the previously constructed duos matrix + if algorithm == 'EDGE-PRESERVATION-SIM-EXACT': + value = E.evaluate_sol(G1,G2,GU._sol) + elif algorithm == 'EDGE-PRESERVATION-SIM-APPROX': + value = E.evaluate_sol(G1,G2,ALG._sol) + + if normalize: + value = normalize_value(value, G1, G2) + + #for getting a symmetric matrix + if j<i: + if duos[j,i] > value: + duos[j,i] = value + duos[i,j] = value + else: + duos[i,j] = duos[j,i] + else: + duos[i][j] = value + + return duos, times, time_limit_reached + + +def sort_matrix(df): + '''sort matrix by row and col indices for easier comparison, inplace + input: df: matrix as pandas dataframe''' + df.sort_index(key=lambda x: (x.to_series().str[3:].astype(int)), axis = 0, inplace=True) + df.sort_index(key=lambda x: (x.to_series().str[3:].astype(int)), axis = 1, inplace=True) + + +def normalize_value(value, G1, G2): + '''normalize similarity value based on the maximum number of edges of the trees G1 and G2 + input: value: similarity value + G1, G2: trees of data type networkx graph''' + edge_count_G1 = G1.number_of_edges() + edge_count_G2 = G2.number_of_edges() + + return value / max(edge_count_G1,edge_count_G2) + +def get_data(path): + '''reads in gml data and returns networkx graphs''' + graph_coll = [] + graph_coll=import_graph_coll(path) + graph_coll=graph_coll_edit(graph_coll) + + return graph_coll + + + +def compute_algorithm(algorithm, in_path, out_path, time_limit=0, normalize=False, fast=False): + '''FUNCTION FOR USE OF ALGORITHM AND NICE RESULTS + computes the given algorithm and returns similarity/distance values, runtime and whether a timelimit was reached + note: exact means the entire matrix is computed. Symmetry is achieved by maximizing over the respective entries + more information see below (only important for APPROX) + + input: algorithm: possibilities 'EDGE-PRESERVATION-SIM-APPROX' for approximation + 'EDGE-PRESERVATION-SIM-EXACT' for exact measure + time_limit: time limit in seconds, note: only implemented for 'EDGE-PRESERVATION-SIM-EXACT' as it is NP-hard + normalize: flag, if true results are normalized by division by max(#edges in trees G1 or G2) + fast: flag, if true only upper half of matrix is computed and then mirrored + -> is less exact for 'EDGE-PRESERVATION-SIM-APPROX' + saves: report file (txt file) + matrices of computed values, runtime and whether the runtime expired (csv files)''' + + E=Evaluator() + ALG=Approx_alg() + GU=Gurobi_solver(0) + + date_time = str(date.today().strftime("%b_%d_%Y"))+ "-" + str(datetime.now().strftime("%H_%M")) + + #get data in gml format + graph_coll = get_data(in_path) + + graph_names_list = import_graph_names(in_path) + + print('in_path ', in_path) + + out_path = out_path + '_results_' + algorithm + "_" + date_time + + os.mkdir(out_path) + f = open(out_path + "/report.txt","a") + + f.write("Report for " + date_time + "\n") + f.write("in_path: " + str(in_path) + "\n") + f.write("outpath: " + str(out_path) + "\n") + f.write("algorithm: " + algorithm + "\n") + + if algorithm == 'EDGE-PRESERVATION-SIM-EXACT': + f.write("time_limit: " + str(time_limit) + "\n") + #always use fast version as fast and exact version do not differ for 'EDGE-PRESERVATION-SIM-EXACT' + f.write("fast version: " + str(True) + "\n") + else: + #fast and exact version only differ for 'EDGE-PRESERVATION-SIM-APPROX' + f.write("fast version: " + str(fast) + "\n") + + + + + duos= np.zeros((len(graph_names_list),len(graph_names_list))) + times=np.zeros((len(graph_names_list),len(graph_names_list))) + time_limit_reached =np.zeros((len(graph_names_list),len(graph_names_list))) + + first_time = time.time() + + if algorithm == 'EDGE-PRESERVATION-SIM-APPROX' and not fast: + #fast and exact version only differ for 'EDGE-PRESERVATION-SIM-APPROX' + duos, times, time_limit_reached = compute_algorithm_helper_exact(algorithm, graph_coll, duos, times, time_limit_reached, time_limit) + else: + #always use fast version as fast and exact version do not differ for 'EDGE-PRESERVATION-SIM-EXACT' + duos, times, time_limit_reached = compute_algorithm_helper_fast(algorithm, graph_coll, duos, times, time_limit_reached, time_limit) + + entire_duration = time.time()-first_time + + + f.write("entire duration: " + str(entire_duration) + "\n") + + df_duos = pd.DataFrame(data=duos, index=graph_names_list, columns=graph_names_list) + df_duos_times = pd.DataFrame(data=times, index=graph_names_list, columns=graph_names_list) + df_duos_limit = pd.DataFrame(data=time_limit_reached, index=graph_names_list, columns=graph_names_list) + + #sort the matrices from small to big according to the name of the files (graph_names_list) + sort_matrix(df_duos) + sort_matrix(df_duos_times) + sort_matrix(df_duos_limit) + + df_duos.to_csv(out_path + '/df_values_' + algorithm + '.csv') + df_duos_times.to_csv(out_path + '/df_times_' + algorithm + '.csv') + df_duos_limit.to_csv(out_path + '/df_time_limit_reached_' + algorithm + '.csv') + + +# choose 'EDGE-PRESERVATION-SIM-APPROX' for approximation or 'EDGE-PRESERVATION-SIM-EXACT' for exact measure +algorithm = 'EDGE-PRESERVATION-SIM-EXACT' +time_limit = 600 #10 min but only applicable and needed for 'EDGE-PRESERVATION-SIM-EXACT' + +result_path = "/home/jana/Documents/BIONETs/Code/tree_match_approx_validator/final_results_data/results/" + +E=Evaluator() +ALG=Approx_alg() +GU=Gurobi_solver(0) + +date_time = str(date.today().strftime("%b_%d_%Y"))+ "-" + str(datetime.now().strftime("%H_%M")) + +path="/home/jana/Documents/BIONETs/Code/tree_match_approx_validator/all_other_data/scalability_trees/tree_blocks_gml/20" + +#path = "/home/jana/Documents/BIONETs/Code/tree_match_approx_validator/all_other_data/gml_data" + +compute_algorithm(algorithm, path, result_path, time_limit=0, normalize=False, fast=False) + +'''for i in range(len(all_max_n)): + + max_n = all_max_n[i] + + + graph_coll = [] + + path="/home/jana/Documents/BIONETs/Code/tree_match_approx_validator/all_other_data/scalability_trees/tree_blocks_gml/" + str(max_n) + + + compute_algorithm(algorithm, path, result_path, time_limit=0, normalize=False)''' + + \ No newline at end of file -- GitLab