Added check for solvent DOD.

rcsb · Jun 13, 2017 · d55ac03 · d55ac03
1 parent b2777aa
commit d55ac03
Showing 1 changed file with 2 additions and 1 deletion.
diff --git a/mmtf-codec/src/main/java/org/rcsb/mmtf/encoder/ReducedEncoder.java b/mmtf-codec/src/main/java/org/rcsb/mmtf/encoder/ReducedEncoder.java
@@ -237,7 +237,8 @@ private static Set<Integer> getIndicesToAdd(StructureDataInterface structure, in
 					atomIndices.add(i);
 				}
 			}
-		} else if (! structure.getGroupName(groupIndex).equals("HOH")){
+		} else if (! structure.getGroupName(groupIndex).equals("HOH")
+				|| structure.getGroupName(groupIndex).equals("DOD")) {
 			// Keep all non-polymer atoms, except for water.
 			// Water should be of type "water", however, a few structures (1ZY8, 2G10, 2Q44, 2Q40)
 			// contain waters as non-polymers. These structures have in common that water has