@@ -98,7 +98,7 @@ export class Mol2Encoder extends LigandEncoder {
let result = iter.next();
while (!result.done) {
const [k, v] = result.value;
- if (NON_METAL_ATOMS.some(a => k.startsWith(a))) {
+ if (this.isNonMetalBond(k)) {
ret.set(k, v);
}
result = iter.next();