@cosmol-studio/cosmolkit-core-analysis 0.5.1-rc.1 → 0.5.1-rc.2
This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.
- package/README.md +6 -1
- package/package.json +2 -2
- package/wasm_wasm.d.ts +146 -146
- package/wasm_wasm.js +556 -556
- package/wasm_wasm_bg.wasm +0 -0
- package/wasm_wasm_bg.wasm.d.ts +112 -112
- /package/snippets/{wasm-wasm-9d018322b8677757/inline1.js → wasm-wasm-e3bae62d6870a044/inline0.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline0.js → wasm-wasm-e3bae62d6870a044/inline1.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline9.js → wasm-wasm-e3bae62d6870a044/inline10.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline11.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline12.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline13.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline14.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline18.js → wasm-wasm-e3bae62d6870a044/inline15.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline15.js → wasm-wasm-e3bae62d6870a044/inline16.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline17.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline16.js → wasm-wasm-e3bae62d6870a044/inline18.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline19.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline3.js → wasm-wasm-e3bae62d6870a044/inline2.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline23.js → wasm-wasm-e3bae62d6870a044/inline20.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline22.js → wasm-wasm-e3bae62d6870a044/inline21.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline24.js → wasm-wasm-e3bae62d6870a044/inline22.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline20.js → wasm-wasm-e3bae62d6870a044/inline23.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline21.js → wasm-wasm-e3bae62d6870a044/inline24.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline28.js → wasm-wasm-e3bae62d6870a044/inline25.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline27.js → wasm-wasm-e3bae62d6870a044/inline26.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline26.js → wasm-wasm-e3bae62d6870a044/inline27.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline25.js → wasm-wasm-e3bae62d6870a044/inline28.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline29.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline2.js → wasm-wasm-e3bae62d6870a044/inline3.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline30.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline31.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline34.js → wasm-wasm-e3bae62d6870a044/inline32.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline32.js → wasm-wasm-e3bae62d6870a044/inline33.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline33.js → wasm-wasm-e3bae62d6870a044/inline34.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline35.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline36.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline37.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline39.js → wasm-wasm-e3bae62d6870a044/inline38.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline41.js → wasm-wasm-e3bae62d6870a044/inline39.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline5.js → wasm-wasm-e3bae62d6870a044/inline4.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline40.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline38.js → wasm-wasm-e3bae62d6870a044/inline41.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline46.js → wasm-wasm-e3bae62d6870a044/inline42.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline43.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline45.js → wasm-wasm-e3bae62d6870a044/inline44.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline42.js → wasm-wasm-e3bae62d6870a044/inline45.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline44.js → wasm-wasm-e3bae62d6870a044/inline46.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline47.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline48.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline49.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline4.js → wasm-wasm-e3bae62d6870a044/inline5.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline50.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline51.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline52.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline54.js → wasm-wasm-e3bae62d6870a044/inline53.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline53.js → wasm-wasm-e3bae62d6870a044/inline54.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline56.js → wasm-wasm-e3bae62d6870a044/inline55.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline55.js → wasm-wasm-e3bae62d6870a044/inline56.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline57.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline63.js → wasm-wasm-e3bae62d6870a044/inline58.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline62.js → wasm-wasm-e3bae62d6870a044/inline59.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline6.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline61.js → wasm-wasm-e3bae62d6870a044/inline60.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline59.js → wasm-wasm-e3bae62d6870a044/inline61.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline60.js → wasm-wasm-e3bae62d6870a044/inline62.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline58.js → wasm-wasm-e3bae62d6870a044/inline63.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline64.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline65.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline66.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline67.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline68.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline69.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline7.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline75.js → wasm-wasm-e3bae62d6870a044/inline70.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline73.js → wasm-wasm-e3bae62d6870a044/inline71.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline71.js → wasm-wasm-e3bae62d6870a044/inline72.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline70.js → wasm-wasm-e3bae62d6870a044/inline73.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline74.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline72.js → wasm-wasm-e3bae62d6870a044/inline75.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline76.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline79.js → wasm-wasm-e3bae62d6870a044/inline77.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline80.js → wasm-wasm-e3bae62d6870a044/inline78.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline78.js → wasm-wasm-e3bae62d6870a044/inline79.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline8.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline77.js → wasm-wasm-e3bae62d6870a044/inline80.js} +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline81.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline82.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline83.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline84.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline85.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757 → wasm-wasm-e3bae62d6870a044}/inline86.js +0 -0
- /package/snippets/{wasm-wasm-9d018322b8677757/inline10.js → wasm-wasm-e3bae62d6870a044/inline9.js} +0 -0
package/README.md
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@@ -219,9 +219,14 @@ The complete component is [`examples/vue/MoleculePanel.vue`](./examples/vue/Mole
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`Molecule` values own Rust allocations. Keep a value while it is in use and
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call `.free()` when a long-lived UI state or worker no longer needs it. Methods
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such as `withHydrogens()`, `
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such as `withHydrogens()`, `with2dCoordinates()`, and
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`addHydrogens_()` and `add2dCoordinates_()`. Their configured forms also retain
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it: `add2dCoordinatesWithParams_(params)`. Use `with2dCoordinates()` or
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package/package.json
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{
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"name": "@cosmol-studio/cosmolkit-core-analysis",
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"version": "0.5.1-rc.
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"version": "0.5.1-rc.2",
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"cosmolkitVersion": "0.5.1-rc.
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"cosmolkitVersion": "0.5.1-rc.2",
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package/wasm_wasm.d.ts
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|
+
set2dCoordinatesWithParams_(coordinates: number[][], params: Coordinate2DInputParams): void;
|
|
1960
|
+
set2dCoordinates_(coordinates: number[][], params?: Coordinate2DInputParams | Coordinate2DInputParamsOptions): void;
|
|
1961
|
+
set3dCoordinatesWithParams_(coordinates: number[][], params: Replace3DCoordinatesParams): void;
|
|
1962
|
+
set3dCoordinates_(coordinates: number[][], params?: Replace3DCoordinatesParams | Replace3DCoordinatesParamsOptions): void;
|
|
1963
|
+
setAtomPositionWithParams_(atom: number, position: [number, number, number], params: AtomPositionParams): void;
|
|
1964
|
+
setAtomPosition_(atom: number, position: [number, number, number], params?: AtomPositionParams | AtomPositionParamsOptions): void;
|
|
1965
1965
|
/**
|
|
1966
1966
|
* Set metadata in place; COW keeps other molecule copies unchanged.
|
|
1967
1967
|
*/
|
|
1968
|
-
|
|
1969
|
-
|
|
1970
|
-
|
|
1968
|
+
setAtomProperty_(atom: number, key: string, value: boolean | number | string | number[] | string[]): void;
|
|
1969
|
+
setOnly3dConformerWithParams_(coordinates: number[][], params: Coordinate3DInputParams): number;
|
|
1970
|
+
setOnly3dConformer_(coordinates: number[][], params?: Coordinate3DInputParams | Coordinate3DInputParamsOptions): number;
|
|
1971
1971
|
slogpVsa10(): number;
|
|
1972
1972
|
slogpVsa11(): number;
|
|
1973
1973
|
slogpVsa12(): number;
|
|
@@ -2689,10 +2689,10 @@ export class SanitizeOperations {
|
|
|
2689
2689
|
or(other: SanitizeOperations): SanitizeOperations;
|
|
2690
2690
|
static readonly ADJUST_HS: SanitizeOperations;
|
|
2691
2691
|
static readonly ALL: SanitizeOperations;
|
|
2692
|
-
static readonly CLEANUP: SanitizeOperations;
|
|
2693
2692
|
static readonly CLEANUP_ATROPISOMERS: SanitizeOperations;
|
|
2694
2693
|
static readonly CLEANUP_CHIRALITY: SanitizeOperations;
|
|
2695
2694
|
static readonly CLEANUP_ORGANOMETALLICS: SanitizeOperations;
|
|
2695
|
+
static readonly CLEANUP: SanitizeOperations;
|
|
2696
2696
|
static readonly FIND_RADICALS: SanitizeOperations;
|
|
2697
2697
|
static readonly KEKULIZE: SanitizeOperations;
|
|
2698
2698
|
static readonly NONE: SanitizeOperations;
|
|
@@ -4407,22 +4407,22 @@ export interface InitOutput {
|
|
|
4407
4407
|
readonly molecularioerror_stage: (a: number) => any;
|
|
4408
4408
|
readonly molecularioerror_threeD: (a: number) => any;
|
|
4409
4409
|
readonly molecularioerror_twoD: (a: number) => any;
|
|
4410
|
-
readonly
|
|
4411
|
-
readonly
|
|
4412
|
-
readonly
|
|
4413
|
-
readonly
|
|
4414
|
-
readonly
|
|
4415
|
-
readonly
|
|
4416
|
-
readonly
|
|
4417
|
-
readonly
|
|
4418
|
-
readonly
|
|
4419
|
-
readonly
|
|
4420
|
-
readonly
|
|
4421
|
-
readonly
|
|
4422
|
-
readonly
|
|
4423
|
-
readonly
|
|
4424
|
-
readonly
|
|
4425
|
-
readonly
|
|
4410
|
+
readonly molecule_add3dConformerWithParams_: (a: number, b: any, c: number) => [number, number, number];
|
|
4411
|
+
readonly molecule_add3dConformer_: (a: number, b: any, c: any) => [number, number, number];
|
|
4412
|
+
readonly molecule_addHydrogensWithParams_: (a: number, b: any) => [number, number];
|
|
4413
|
+
readonly molecule_addHydrogens_: (a: number, b: any) => [number, number];
|
|
4414
|
+
readonly molecule_assignAromaticityWithParams_: (a: number, b: number) => [number, number];
|
|
4415
|
+
readonly molecule_assignAromaticity_: (a: number, b: any) => [number, number];
|
|
4416
|
+
readonly molecule_assignChiralTagsFromStructureWithParams_: (a: number, b: number) => [number, number];
|
|
4417
|
+
readonly molecule_assignChiralTagsFromStructure_: (a: number, b: any) => [number, number];
|
|
4418
|
+
readonly molecule_assignCipLabelsWithOptions_: (a: number, b: number) => [number, number];
|
|
4419
|
+
readonly molecule_assignCipLabels_: (a: number, b: any) => [number, number];
|
|
4420
|
+
readonly molecule_assignRadicals_: (a: number) => [number, number];
|
|
4421
|
+
readonly molecule_assignRingFamiliesWithParams_: (a: number, b: any) => [number, number];
|
|
4422
|
+
readonly molecule_assignRingFamilies_: (a: number, b: any) => [number, number];
|
|
4423
|
+
readonly molecule_assignRings_: (a: number) => [number, number];
|
|
4424
|
+
readonly molecule_assignValenceWithParams_: (a: number, b: number) => [number, number];
|
|
4425
|
+
readonly molecule_assignValence_: (a: number, b: any) => [number, number];
|
|
4426
4426
|
readonly molecule_atom: (a: number, b: any) => [number, number, number];
|
|
4427
4427
|
readonly molecule_atomMetadata: (a: number, b: any) => [number, number, number, number];
|
|
4428
4428
|
readonly molecule_atomProperty: (a: number, b: any, c: number, d: number) => [number, number, number];
|
|
@@ -4459,7 +4459,7 @@ export interface InitOutput {
|
|
|
4459
4459
|
readonly molecule_chiNV: (a: number, b: any) => [number, number, number];
|
|
4460
4460
|
readonly molecule_chiNVWithParams: (a: number, b: any, c: any) => [number, number, number];
|
|
4461
4461
|
readonly molecule_cipComputed: (a: number) => [number, number, number];
|
|
4462
|
-
readonly
|
|
4462
|
+
readonly molecule_clear3dConformers_: (a: number) => [number, number];
|
|
4463
4463
|
readonly molecule_conformers3d: (a: number) => any;
|
|
4464
4464
|
readonly molecule_coordinates2d: (a: number) => [number, number];
|
|
4465
4465
|
readonly molecule_coordinates3d: (a: number, b: any) => [number, number, number, number];
|
|
@@ -4549,8 +4549,8 @@ export interface InitOutput {
|
|
|
4549
4549
|
readonly molecule_kappa1: (a: number) => [number, number, number];
|
|
4550
4550
|
readonly molecule_kappa2: (a: number) => [number, number, number];
|
|
4551
4551
|
readonly molecule_kappa3: (a: number) => [number, number, number];
|
|
4552
|
-
readonly
|
|
4553
|
-
readonly
|
|
4552
|
+
readonly molecule_kekulizeBondsWithParams_: (a: number, b: any) => [number, number];
|
|
4553
|
+
readonly molecule_kekulizeBonds_: (a: number, b: any) => [number, number];
|
|
4554
4554
|
readonly molecule_labuteAsa: (a: number) => [number, number, number];
|
|
4555
4555
|
readonly molecule_labuteAsaContributions: (a: number) => [number, number, number];
|
|
4556
4556
|
readonly molecule_labuteAsaContributionsWithParams: (a: number, b: any, c: any) => [number, number, number];
|
|
@@ -4611,23 +4611,23 @@ export interface InitOutput {
|
|
|
4611
4611
|
readonly molecule_readSdf: (a: number, b: number, c: any) => [number, number, number];
|
|
4612
4612
|
readonly molecule_readSdfWithParams: (a: number, b: number, c: any) => [number, number, number];
|
|
4613
4613
|
readonly molecule_readXyz: (a: number, b: number) => [number, number, number];
|
|
4614
|
-
readonly
|
|
4615
|
-
readonly
|
|
4614
|
+
readonly molecule_removeHydrogensWithParams_: (a: number, b: any) => [number, number];
|
|
4615
|
+
readonly molecule_removeHydrogens_: (a: number, b: any) => [number, number];
|
|
4616
4616
|
readonly molecule_sanitize: (a: number, b: any) => [number, number, number];
|
|
4617
4617
|
readonly molecule_sanitizeWithParams: (a: number, b: any) => [number, number, number];
|
|
4618
4618
|
readonly molecule_sanitizeWithParams_: (a: number, b: any) => [number, number];
|
|
4619
4619
|
readonly molecule_sanitize_: (a: number, b: any) => [number, number];
|
|
4620
4620
|
readonly molecule_sdfDataFieldNames: (a: number) => [number, number, number, number];
|
|
4621
4621
|
readonly molecule_sdfDataFieldOrEmpty: (a: number, b: number, c: number) => [number, number, number, number];
|
|
4622
|
-
readonly
|
|
4623
|
-
readonly
|
|
4624
|
-
readonly
|
|
4625
|
-
readonly
|
|
4626
|
-
readonly
|
|
4627
|
-
readonly
|
|
4628
|
-
readonly
|
|
4629
|
-
readonly
|
|
4630
|
-
readonly
|
|
4622
|
+
readonly molecule_set2dCoordinatesWithParams_: (a: number, b: any, c: number) => [number, number];
|
|
4623
|
+
readonly molecule_set2dCoordinates_: (a: number, b: any, c: any) => [number, number];
|
|
4624
|
+
readonly molecule_set3dCoordinatesWithParams_: (a: number, b: any, c: number) => [number, number];
|
|
4625
|
+
readonly molecule_set3dCoordinates_: (a: number, b: any, c: any) => [number, number];
|
|
4626
|
+
readonly molecule_setAtomPositionWithParams_: (a: number, b: any, c: any, d: number) => [number, number];
|
|
4627
|
+
readonly molecule_setAtomPosition_: (a: number, b: any, c: any, d: any) => [number, number];
|
|
4628
|
+
readonly molecule_setAtomProperty_: (a: number, b: any, c: number, d: number, e: any) => [number, number];
|
|
4629
|
+
readonly molecule_setOnly3dConformerWithParams_: (a: number, b: any, c: number) => [number, number, number];
|
|
4630
|
+
readonly molecule_setOnly3dConformer_: (a: number, b: any, c: any) => [number, number, number];
|
|
4631
4631
|
readonly molecule_slogpVsa: (a: number) => [number, number, number, number];
|
|
4632
4632
|
readonly molecule_slogpVsa1: (a: number) => [number, number, number];
|
|
4633
4633
|
readonly molecule_slogpVsa10: (a: number) => [number, number, number];
|
|
@@ -5644,88 +5644,88 @@ export interface InitOutput {
|
|
|
5644
5644
|
readonly xyzwriteparams_precision: (a: number) => number;
|
|
5645
5645
|
readonly xyzwriteparams_set_conformerId: (a: number, b: any) => [number, number];
|
|
5646
5646
|
readonly xyzwriteparams_set_precision: (a: number, b: any) => [number, number];
|
|
5647
|
-
readonly
|
|
5648
|
-
readonly
|
|
5649
|
-
readonly
|
|
5650
|
-
readonly
|
|
5651
|
-
readonly
|
|
5652
|
-
readonly
|
|
5653
|
-
readonly
|
|
5654
|
-
readonly
|
|
5655
|
-
readonly
|
|
5656
|
-
readonly
|
|
5657
|
-
readonly
|
|
5658
|
-
readonly
|
|
5659
|
-
readonly
|
|
5660
|
-
readonly
|
|
5661
|
-
readonly
|
|
5662
|
-
readonly
|
|
5663
|
-
readonly
|
|
5664
|
-
readonly
|
|
5665
|
-
readonly
|
|
5666
|
-
readonly
|
|
5667
|
-
readonly
|
|
5668
|
-
readonly
|
|
5669
|
-
readonly
|
|
5670
|
-
readonly
|
|
5671
|
-
readonly
|
|
5672
|
-
readonly
|
|
5673
|
-
readonly
|
|
5674
|
-
readonly
|
|
5675
|
-
readonly
|
|
5676
|
-
readonly
|
|
5677
|
-
readonly
|
|
5678
|
-
readonly
|
|
5679
|
-
readonly
|
|
5680
|
-
readonly
|
|
5681
|
-
readonly
|
|
5682
|
-
readonly
|
|
5683
|
-
readonly
|
|
5684
|
-
readonly
|
|
5685
|
-
readonly
|
|
5686
|
-
readonly
|
|
5687
|
-
readonly
|
|
5688
|
-
readonly
|
|
5689
|
-
readonly
|
|
5690
|
-
readonly
|
|
5691
|
-
readonly
|
|
5692
|
-
readonly
|
|
5693
|
-
readonly
|
|
5694
|
-
readonly
|
|
5695
|
-
readonly
|
|
5696
|
-
readonly
|
|
5697
|
-
readonly
|
|
5698
|
-
readonly
|
|
5699
|
-
readonly
|
|
5700
|
-
readonly
|
|
5701
|
-
readonly
|
|
5702
|
-
readonly
|
|
5703
|
-
readonly
|
|
5704
|
-
readonly
|
|
5705
|
-
readonly
|
|
5706
|
-
readonly
|
|
5707
|
-
readonly
|
|
5708
|
-
readonly
|
|
5709
|
-
readonly
|
|
5710
|
-
readonly
|
|
5711
|
-
readonly
|
|
5712
|
-
readonly
|
|
5713
|
-
readonly
|
|
5714
|
-
readonly
|
|
5715
|
-
readonly
|
|
5716
|
-
readonly
|
|
5717
|
-
readonly
|
|
5718
|
-
readonly
|
|
5719
|
-
readonly
|
|
5720
|
-
readonly
|
|
5721
|
-
readonly
|
|
5722
|
-
readonly
|
|
5723
|
-
readonly
|
|
5724
|
-
readonly
|
|
5725
|
-
readonly
|
|
5726
|
-
readonly
|
|
5727
|
-
readonly
|
|
5728
|
-
readonly
|
|
5647
|
+
readonly wasm_bindgen__convert__closures________invoke__h004c26581096706e: (a: number, b: number, c: number) => void;
|
|
5648
|
+
readonly wasm_bindgen__convert__closures________invoke__h0120d718c864c757: (a: number, b: number, c: number) => void;
|
|
5649
|
+
readonly wasm_bindgen__convert__closures________invoke__h05966eb1b4f558ff: (a: number, b: number, c: number) => void;
|
|
5650
|
+
readonly wasm_bindgen__convert__closures________invoke__h05966eb1b4f558ff_1347: (a: number, b: number, c: number) => void;
|
|
5651
|
+
readonly wasm_bindgen__convert__closures________invoke__h05966eb1b4f558ff_1349: (a: number, b: number, c: number) => void;
|
|
5652
|
+
readonly wasm_bindgen__convert__closures________invoke__h05966eb1b4f558ff_1631: (a: number, b: number, c: number) => void;
|
|
5653
|
+
readonly wasm_bindgen__convert__closures________invoke__h05966eb1b4f558ff_1830: (a: number, b: number, c: number) => void;
|
|
5654
|
+
readonly wasm_bindgen__convert__closures________invoke__h05966eb1b4f558ff_710: (a: number, b: number, c: number) => void;
|
|
5655
|
+
readonly wasm_bindgen__convert__closures________invoke__h05966eb1b4f558ff_797: (a: number, b: number, c: number) => void;
|
|
5656
|
+
readonly wasm_bindgen__convert__closures________invoke__h065458725f56e016: (a: number, b: number, c: number) => void;
|
|
5657
|
+
readonly wasm_bindgen__convert__closures________invoke__h075e63be36e95146: (a: number, b: number, c: number) => void;
|
|
5658
|
+
readonly wasm_bindgen__convert__closures________invoke__h075e63be36e95146_1047: (a: number, b: number, c: number) => void;
|
|
5659
|
+
readonly wasm_bindgen__convert__closures________invoke__h075e63be36e95146_1345: (a: number, b: number, c: number) => void;
|
|
5660
|
+
readonly wasm_bindgen__convert__closures________invoke__h075e63be36e95146_1379: (a: number, b: number, c: number) => void;
|
|
5661
|
+
readonly wasm_bindgen__convert__closures________invoke__h075e63be36e95146_1800: (a: number, b: number, c: number) => void;
|
|
5662
|
+
readonly wasm_bindgen__convert__closures________invoke__h075e63be36e95146_709: (a: number, b: number, c: number) => void;
|
|
5663
|
+
readonly wasm_bindgen__convert__closures________invoke__h075e63be36e95146_798: (a: number, b: number, c: number) => void;
|
|
5664
|
+
readonly wasm_bindgen__convert__closures________invoke__h186758e92d3a7c10: (a: number, b: number, c: number) => void;
|
|
5665
|
+
readonly wasm_bindgen__convert__closures________invoke__h186758e92d3a7c10_1244: (a: number, b: number, c: number) => void;
|
|
5666
|
+
readonly wasm_bindgen__convert__closures________invoke__h186758e92d3a7c10_1449: (a: number, b: number, c: number) => void;
|
|
5667
|
+
readonly wasm_bindgen__convert__closures________invoke__h186758e92d3a7c10_1503: (a: number, b: number, c: number) => void;
|
|
5668
|
+
readonly wasm_bindgen__convert__closures________invoke__h186758e92d3a7c10_1650: (a: number, b: number, c: number) => void;
|
|
5669
|
+
readonly wasm_bindgen__convert__closures________invoke__h186758e92d3a7c10_1651: (a: number, b: number, c: number) => void;
|
|
5670
|
+
readonly wasm_bindgen__convert__closures________invoke__h186758e92d3a7c10_1809: (a: number, b: number, c: number) => void;
|
|
5671
|
+
readonly wasm_bindgen__convert__closures________invoke__h186758e92d3a7c10_1810: (a: number, b: number, c: number) => void;
|
|
5672
|
+
readonly wasm_bindgen__convert__closures________invoke__h186758e92d3a7c10_601: (a: number, b: number, c: number) => void;
|
|
5673
|
+
readonly wasm_bindgen__convert__closures________invoke__h186758e92d3a7c10_960: (a: number, b: number, c: number) => void;
|
|
5674
|
+
readonly wasm_bindgen__convert__closures________invoke__h1fb6ebc5d8e44234: (a: number, b: number, c: number) => void;
|
|
5675
|
+
readonly wasm_bindgen__convert__closures________invoke__h29f477e36ba76b39: (a: number, b: number, c: number) => void;
|
|
5676
|
+
readonly wasm_bindgen__convert__closures________invoke__h29f477e36ba76b39_1661: (a: number, b: number, c: number) => void;
|
|
5677
|
+
readonly wasm_bindgen__convert__closures________invoke__h29f477e36ba76b39_1696: (a: number, b: number, c: number) => void;
|
|
5678
|
+
readonly wasm_bindgen__convert__closures________invoke__h29f477e36ba76b39_1699: (a: number, b: number, c: number) => void;
|
|
5679
|
+
readonly wasm_bindgen__convert__closures________invoke__h29f477e36ba76b39_1808: (a: number, b: number, c: number) => void;
|
|
5680
|
+
readonly wasm_bindgen__convert__closures________invoke__h29f477e36ba76b39_1811: (a: number, b: number, c: number) => void;
|
|
5681
|
+
readonly wasm_bindgen__convert__closures________invoke__h29f477e36ba76b39_1856: (a: number, b: number, c: number) => void;
|
|
5682
|
+
readonly wasm_bindgen__convert__closures________invoke__h29f477e36ba76b39_1859: (a: number, b: number, c: number) => void;
|
|
5683
|
+
readonly wasm_bindgen__convert__closures________invoke__h29f477e36ba76b39_484: (a: number, b: number, c: number) => void;
|
|
5684
|
+
readonly wasm_bindgen__convert__closures________invoke__h332e8a16d750e1ee: (a: number, b: number, c: number) => void;
|
|
5685
|
+
readonly wasm_bindgen__convert__closures________invoke__h332e8a16d750e1ee_1195: (a: number, b: number, c: number) => void;
|
|
5686
|
+
readonly wasm_bindgen__convert__closures________invoke__h36a6172f4daf4173: (a: number, b: number, c: number) => void;
|
|
5687
|
+
readonly wasm_bindgen__convert__closures________invoke__h3c04c09854d3c789: (a: number, b: number, c: number) => void;
|
|
5688
|
+
readonly wasm_bindgen__convert__closures________invoke__h45c1c37c3b4c285c: (a: number, b: number, c: number) => void;
|
|
5689
|
+
readonly wasm_bindgen__convert__closures________invoke__h49fc34f101990ab0: (a: number, b: number, c: number) => void;
|
|
5690
|
+
readonly wasm_bindgen__convert__closures________invoke__h4b0d8b26c023a7ea: (a: number, b: number, c: number) => void;
|
|
5691
|
+
readonly wasm_bindgen__convert__closures________invoke__h4c90eaacfc9245a4: (a: number, b: number, c: number) => void;
|
|
5692
|
+
readonly wasm_bindgen__convert__closures________invoke__h51252e2cf3b6bda7: (a: number, b: number, c: number) => void;
|
|
5693
|
+
readonly wasm_bindgen__convert__closures________invoke__h51f8d6437ae404be: (a: number, b: number, c: number) => void;
|
|
5694
|
+
readonly wasm_bindgen__convert__closures________invoke__h535293f6d7c1d91d: (a: number, b: number, c: number) => void;
|
|
5695
|
+
readonly wasm_bindgen__convert__closures________invoke__h535293f6d7c1d91d_1204: (a: number, b: number, c: number) => void;
|
|
5696
|
+
readonly wasm_bindgen__convert__closures________invoke__h535293f6d7c1d91d_1217: (a: number, b: number, c: number) => void;
|
|
5697
|
+
readonly wasm_bindgen__convert__closures________invoke__h535293f6d7c1d91d_708: (a: number, b: number, c: number) => void;
|
|
5698
|
+
readonly wasm_bindgen__convert__closures________invoke__h535293f6d7c1d91d_711: (a: number, b: number, c: number) => void;
|
|
5699
|
+
readonly wasm_bindgen__convert__closures________invoke__h5d74dd5cb1c565fb: (a: number, b: number, c: number) => void;
|
|
5700
|
+
readonly wasm_bindgen__convert__closures________invoke__h5d74dd5cb1c565fb_1593: (a: number, b: number, c: number) => void;
|
|
5701
|
+
readonly wasm_bindgen__convert__closures________invoke__h5d74dd5cb1c565fb_1595: (a: number, b: number, c: number) => void;
|
|
5702
|
+
readonly wasm_bindgen__convert__closures________invoke__h600ea7c7dc2dbdd2: (a: number, b: number, c: number) => void;
|
|
5703
|
+
readonly wasm_bindgen__convert__closures________invoke__h600ea7c7dc2dbdd2_1243: (a: number, b: number, c: number) => void;
|
|
5704
|
+
readonly wasm_bindgen__convert__closures________invoke__h601177b4d8b8a1d3: (a: number, b: number, c: number) => void;
|
|
5705
|
+
readonly wasm_bindgen__convert__closures________invoke__h65abeff50ac1f00c: (a: number, b: number, c: number) => void;
|
|
5706
|
+
readonly wasm_bindgen__convert__closures________invoke__h68491a321d17743b: (a: number, b: number, c: number) => void;
|
|
5707
|
+
readonly wasm_bindgen__convert__closures________invoke__h6db8bf8a4d57c915: (a: number, b: number, c: number) => void;
|
|
5708
|
+
readonly wasm_bindgen__convert__closures________invoke__h6db8bf8a4d57c915_1857: (a: number, b: number, c: number) => void;
|
|
5709
|
+
readonly wasm_bindgen__convert__closures________invoke__h6db8bf8a4d57c915_1858: (a: number, b: number, c: number) => void;
|
|
5710
|
+
readonly wasm_bindgen__convert__closures________invoke__h6fd108e02e865648: (a: number, b: number, c: number) => void;
|
|
5711
|
+
readonly wasm_bindgen__convert__closures________invoke__h740669b9dbf776d7: (a: number, b: number, c: number) => void;
|
|
5712
|
+
readonly wasm_bindgen__convert__closures________invoke__h8f6afa43923235d0: (a: number, b: number, c: number) => void;
|
|
5713
|
+
readonly wasm_bindgen__convert__closures________invoke__h8f87db4988166dc5: (a: number, b: number, c: number) => void;
|
|
5714
|
+
readonly wasm_bindgen__convert__closures________invoke__h8feb03f074fcac83: (a: number, b: number, c: number) => void;
|
|
5715
|
+
readonly wasm_bindgen__convert__closures________invoke__h9476781108f3eb66: (a: number, b: number, c: number) => void;
|
|
5716
|
+
readonly wasm_bindgen__convert__closures________invoke__h94ec4ff42ce12891: (a: number, b: number, c: number) => void;
|
|
5717
|
+
readonly wasm_bindgen__convert__closures________invoke__h9978cb81d0287d72: (a: number, b: number, c: number) => void;
|
|
5718
|
+
readonly wasm_bindgen__convert__closures________invoke__h9a5522ed89e2283d: (a: number, b: number, c: number) => void;
|
|
5719
|
+
readonly wasm_bindgen__convert__closures________invoke__h9d0dce60c45ac295: (a: number, b: number, c: number) => void;
|
|
5720
|
+
readonly wasm_bindgen__convert__closures________invoke__ha5979eaaa6dc2eb0: (a: number, b: number, c: number) => void;
|
|
5721
|
+
readonly wasm_bindgen__convert__closures________invoke__ha77f0e324a3dedd4: (a: number, b: number, c: number) => void;
|
|
5722
|
+
readonly wasm_bindgen__convert__closures________invoke__hc4236bc8db2d6b53: (a: number, b: number, c: number) => void;
|
|
5723
|
+
readonly wasm_bindgen__convert__closures________invoke__hc4be6bcb7d37cfce: (a: number, b: number, c: number) => void;
|
|
5724
|
+
readonly wasm_bindgen__convert__closures________invoke__hc815850c98176d67: (a: number, b: number, c: number) => void;
|
|
5725
|
+
readonly wasm_bindgen__convert__closures________invoke__hd14e3744942cc941: (a: number, b: number, c: number) => void;
|
|
5726
|
+
readonly wasm_bindgen__convert__closures________invoke__hd2f057ef65dcd3ee: (a: number, b: number, c: number) => void;
|
|
5727
|
+
readonly wasm_bindgen__convert__closures________invoke__hde40dd4c87810226: (a: number, b: number, c: number) => void;
|
|
5728
|
+
readonly wasm_bindgen__convert__closures________invoke__hde4ce1b45dc3fc92: (a: number, b: number, c: number) => void;
|
|
5729
5729
|
readonly __wbindgen_malloc: (a: number, b: number) => number;
|
|
5730
5730
|
readonly __wbindgen_realloc: (a: number, b: number, c: number, d: number) => number;
|
|
5731
5731
|
readonly __wbindgen_exn_store: (a: number) => void;
|