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@@ -148,6 +148,11 @@ export const SaccharideComponentTypeNames = [
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'D-SACCHARIDE', 'SACCHARIDE',
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]
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+/** Chemical component type names for other */
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+export const OtherComponentTypeNames = [
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+ 'NON-POLYMER', 'OTHER'
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+]
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+
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/** Common names for water molecules */
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export const WaterNames = [
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'SOL', 'WAT', 'HOH', 'H2O', 'W', 'DOD', 'D3O', 'TIP3', 'TIP4', 'SPC'
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@@ -185,6 +190,8 @@ export function getMoleculeType(compType: string, compId: string) {
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return MoleculeType.water
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} else if (IonNames.includes(compId)) {
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return MoleculeType.ion
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+ } else if (OtherComponentTypeNames.includes(compType)) {
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+ return MoleculeType.other
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} else {
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return MoleculeType.unknown
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}
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