Links created parameter added to genetic search.

Smoren · Dec 28, 2024 · 0712f30 · 0712f30
1 parent cde4a66
commit 0712f30
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Showing 4 changed files with 7 additions and 1 deletion.
diff --git a/data/input/default-clusterization-weights.json b/data/input/default-clusterization-weights.json
@@ -12,5 +12,6 @@
   "radiusWeight": 1,
   "speedWeight": 0.5,
   "relativeCompoundedAtomsCountWeight": 1,
-  "relativeLinksCountWeight": 1
+  "relativeLinksCountWeight": 1,
+  "linksCreatedWeight": 1
 }
diff --git a/src/lib/analysis/utils.ts b/src/lib/analysis/utils.ts
@@ -186,6 +186,7 @@ export function createDefaultClusterizationWeightsConfig(): ClusterizationWeight
     speedWeight: 0.5,
     relativeCompoundedAtomsCountWeight: 1,
     relativeLinksCountWeight: 1,
+    linksCreatedWeight: 1,
   };
 }
 
@@ -205,5 +206,6 @@ export function createModifiedClusterizationWeightsConfig(): ClusterizationWeigh
     speedWeight: 0.5,
     relativeCompoundedAtomsCountWeight: 1,
     relativeLinksCountWeight: 1,
+    linksCreatedWeight: 1,
   };
 }
diff --git a/src/lib/genetic/grade.ts b/src/lib/genetic/grade.ts
@@ -78,6 +78,7 @@ export async function runSimulationForClustersGrade(
     );
     const clustersMetrics = calcMetricsForCompoundClustersSummary(clustersSummary, weights);
     const [clustersScore, clusterSize, clustersCount, relativeClustered, relativeFiltered] = clustersMetrics;
+    const linksCreated = sim.summary.LINKS_CREATED[0];
     const rawMatrix = [
       clustersScore,
       clusterSize ** weights.clusterSizeWeight,
@@ -86,6 +87,7 @@ export async function runSimulationForClustersGrade(
       relativeFiltered ** weights.relativeFilteredCountWeight,
       relativeCompoundedAtomsCount ** weights.relativeCompoundedAtomsCountWeight,
       relativeLinksCount ** weights.relativeLinksCountWeight,
+      linksCreated ** weights.linksCreatedWeight,
     ];
     summaryMatrix.push(rawMatrix);
 

diff --git a/src/lib/genetic/types.ts b/src/lib/genetic/types.ts
@@ -100,4 +100,5 @@ export type ClusterizationWeightsConfig = {
   speedWeight: number;
   relativeCompoundedAtomsCountWeight: number;
   relativeLinksCountWeight: number;
+  linksCreatedWeight: number;
 }