@cosmol-studio/cosmolkit-core-analysis 0.6.0-dev.1 → 0.6.0-rc.2

package/cosmolkit_wasm.d.ts

@@ -5725,7 +5725,7 @@ export class MoleculeBatch {
     fingerprintPattern(options?: PatternFingerprintParams | PatternFingerprintParamsOptions | null, runtime?: BatchQueryParams | BatchQueryParamsOptions | null, n_jobs?: IndexInput | null, progress_bar?: BoolInput | null): FingerprintBatch;
     fingerprintTopologicalTorsionWithParams(options: TopologicalTorsionFingerprintParams | TopologicalTorsionFingerprintParamsOptions, runtime: BatchQueryParams | BatchQueryParamsOptions): FingerprintBatch;
     fingerprintTopologicalTorsion(options?: TopologicalTorsionFingerprintParams | TopologicalTorsionFingerprintParamsOptions | null, runtime?: BatchQueryParams | BatchQueryParamsOptions | null, n_jobs?: IndexInput | null, progress_bar?: BoolInput | null): FingerprintBatch;
-    static fromRecords(records: ReadonlyArray<Molecule | BatchError>, mode: BatchErrorMode): MoleculeBatch;
+    static fromRecords(records: ReadonlyArray<Molecule | BatchError>, errors: BatchErrorMode): MoleculeBatch;
     static fromSdfRecordsWithParams(text: TextInput, read: SdfReadParams | SdfReadParamsOptions, errors?: BatchErrorMode | null, n_jobs?: IndexInput | null, progress_bar?: BoolInput | null): MoleculeBatch;
     static fromSdfRecords(text: TextInput, read?: SdfReadParams | SdfReadParamsOptions | null, errors?: BatchErrorMode | null, n_jobs?: IndexInput | null, progress_bar?: BoolInput | null): MoleculeBatch;
     static fromSmilesListWithParams(smiles: TextArray, parse: SmilesParseParams | SmilesParseParamsOptions, params: BatchParams | BatchParamsOptions): MoleculeBatch;
@@ -9084,8 +9084,8 @@ export class SubstructMatchParams {
     /**
      * Optional caller-provided atom compatibility check.
      */
-    get extraAtomCheck(): ((query: QueryAtom, target: Atom) => boolean) | undefined;
-    set extraAtomCheck(value: ((query: QueryAtom, target: Atom) => boolean) | null | undefined);
+    get extraAtomCheck(): ((query: QueryGraph, queryAtom: QueryAtom, target: Molecule, targetAtom: Atom) => boolean) | undefined;
+    set extraAtomCheck(value: ((query: QueryGraph, queryAtom: QueryAtom, target: Molecule, targetAtom: Atom) => boolean) | null | undefined);
     /**
      * Whether `extra_bond_check` replaces the default bond comparison.
      */
@@ -10172,7 +10172,7 @@ export function molFromSmiles(smiles: TextInput, params?: SmilesParseParams | Sm
 
 export function molFromXyzBlock(text: TextInput): Molecule;
 
-export function molsFromRecords(records: ReadonlyArray<Molecule | BatchError>, mode: BatchErrorMode): MoleculeBatch;
+export function molsFromRecords(records: ReadonlyArray<Molecule | BatchError>, errors: BatchErrorMode): MoleculeBatch;
 
 export function molsFromSdfRecords(text: TextInput, read?: SdfReadParams | SdfReadParamsOptions | null, errors?: BatchErrorMode | null, n_jobs?: IndexInput | null, progress_bar?: BoolInput | null): MoleculeBatch;
 
@@ -14080,98 +14080,98 @@ export interface InitOutput {
     readonly xyzwriteparams_precision: (a: number, b: number) => void;
     readonly xyzwriteparams_set_conformerId: (a: number, b: number, c: number) => void;
     readonly xyzwriteparams_set_precision: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3468: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3471: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3472: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3473: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3474: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3475: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3476: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3481: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3482: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3483: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3484: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3485: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3486: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3487: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3489: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3492: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3493: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3498: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3499: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3500: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3501: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3504: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3505: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3506: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3507: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3508: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3509: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3510: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3514: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3516: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3517: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3519: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3530: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3531: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3532: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3533: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3534: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3535: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3537: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3538: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3540: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3541: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3543: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3544: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3546: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3547: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3548: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3549: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_3550: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_40: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_42: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_43: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_708_44: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_713: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_715: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_717: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_719: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_719_2578: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_725: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_729: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_731: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_731_3503: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_731_3515: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_731_3539: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_731_3542: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_731_3545: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_731_3551: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_733: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3468: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3471: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3472: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3473: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3474: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3475: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3476: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3481: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3482: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3483: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3484: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3485: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3486: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3487: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3489: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3492: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3493: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3498: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3499: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3500: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3501: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3504: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3505: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3506: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3507: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3508: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3509: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3510: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3514: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3516: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3517: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3519: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3530: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3531: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3532: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3533: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3534: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3535: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3537: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3538: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3540: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3541: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3543: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3544: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3546: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3547: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3548: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3549: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_3550: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_40: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_42: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_43: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_711_44: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_716: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_718: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_720: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_722: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_722_2578: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_728: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_732: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_734: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_734_3503: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_734_3515: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_734_3539: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_734_3542: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_734_3545: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_734_3551: (a: number, b: number, c: number) => void;
     readonly __wasm_bindgen_func_elem_736: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_736_3502: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_736_3523: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_740: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_744: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_746: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_748: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_750: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_752: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_754: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_756: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_762: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_764: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_766: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_768: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_770: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_774: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_776: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_780: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_782: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_784: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_786: (a: number, b: number, c: number) => void;
-    readonly __wasm_bindgen_func_elem_790: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_739: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_739_3502: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_739_3523: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_743: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_747: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_749: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_751: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_753: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_755: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_757: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_759: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_765: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_767: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_769: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_771: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_773: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_777: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_779: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_783: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_785: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_787: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_789: (a: number, b: number, c: number) => void;
+    readonly __wasm_bindgen_func_elem_793: (a: number, b: number, c: number) => void;
     readonly __wbindgen_export: (a: number, b: number) => number;
     readonly __wbindgen_export2: (a: number, b: number, c: number, d: number) => number;
     readonly __wbindgen_export3: (a: number) => void;