@cosmol-studio/cosmolkit-core-reaction 0.5.0-rc.22 → 0.5.0

package/package.json

@@ -1,11 +1,11 @@
 {
   "name": "@cosmol-studio/cosmolkit-core-reaction",
-  "version": "0.5.0-rc.22",
+  "version": "0.5.0",
   "cosmolkitPreset": "core-reaction",
-  "cosmolkitVersion": "0.5.0-rc.22",
+  "cosmolkitVersion": "0.5.0",
   "publishConfig": {
     "access": "public",
-    "tag": "rc"
+    "tag": "latest"
   },
   "description": "WebAssembly bindings for COSMolKit",
   "type": "module",

package/wasm_wasm.d.ts

@@ -247,8 +247,8 @@ export class CxSmilesFields {
     bits(): number;
     contains(other: CxSmilesFields): boolean;
     or(other: CxSmilesFields): CxSmilesFields;
-    static readonly ALL_BUT_COORDS: CxSmilesFields;
     static readonly ALL: CxSmilesFields;
+    static readonly ALL_BUT_COORDS: CxSmilesFields;
     static readonly ATOM_LABELS: CxSmilesFields;
     static readonly ATOM_PROPS: CxSmilesFields;
     static readonly BOND_ATROPISOMER: CxSmilesFields;
@@ -597,10 +597,10 @@ export class Molecule {
     [Symbol.dispose](): void;
     addHydrogensWithParams(params: AddHsParams): void;
     addHydrogens(): void;
-    applyReactionWithParams_(reaction: Reaction, params: ReactionApplyParams): boolean;
     applyReactionWithParams(reaction: Reaction, params: ReactionApplyParams): ReactionApplyResult;
-    applyReaction_(reaction: Reaction): boolean;
+    applyReactionWithParams_(reaction: Reaction, params: ReactionApplyParams): boolean;
     applyReaction(reaction: Reaction): ReactionApplyResult;
+    applyReaction_(reaction: Reaction): boolean;
     assignAromaticityWithParams(params: AromaticityParams): void;
     assignAromaticity(): void;
     assignRadicals(): void;
@@ -697,10 +697,10 @@ export class Molecule {
     static readXyz(text: string): Molecule;
     removeHydrogensWithParams(params: RemoveHsParams): void;
     removeHydrogens(): void;
-    sanitizeWithParams_(params: SanitizeParams): void;
     sanitizeWithParams(params: SanitizeParams): Molecule;
-    sanitize_(): void;
+    sanitizeWithParams_(params: SanitizeParams): void;
     sanitize(): Molecule;
+    sanitize_(): void;
     /**
      * Returns SDF data-field names in their source order, including duplicates.
      */
@@ -1296,10 +1296,10 @@ export class SanitizeOperations {
     or(other: SanitizeOperations): SanitizeOperations;
     static readonly ADJUST_HS: SanitizeOperations;
     static readonly ALL: SanitizeOperations;
+    static readonly CLEANUP: SanitizeOperations;
     static readonly CLEANUP_ATROPISOMERS: SanitizeOperations;
     static readonly CLEANUP_CHIRALITY: SanitizeOperations;
     static readonly CLEANUP_ORGANOMETALLICS: SanitizeOperations;
-    static readonly CLEANUP: SanitizeOperations;
     static readonly FIND_RADICALS: SanitizeOperations;
     static readonly KEKULIZE: SanitizeOperations;
     static readonly NONE: SanitizeOperations;
@@ -2795,35 +2795,35 @@ export interface InitOutput {
     readonly xyzwriteparams_conformerId: (a: number) => any;
     readonly xyzwriteparams_new: (a: any, b: any) => [number, number, number];
     readonly xyzwriteparams_precision: (a: number) => number;
-    readonly wasm_bindgen__convert__closures________invoke__h0917cdd173e2eb3a: (a: number, b: number, c: number) => void;
-    readonly wasm_bindgen__convert__closures________invoke__h0917cdd173e2eb3a_567: (a: number, b: number, c: number) => void;
-    readonly wasm_bindgen__convert__closures________invoke__h0917cdd173e2eb3a_783: (a: number, b: number, c: number) => void;
-    readonly wasm_bindgen__convert__closures________invoke__h0c92ba76dd9a7bf3: (a: number, b: number, c: number) => void;
-    readonly wasm_bindgen__convert__closures________invoke__h1dddc68d628829d3: (a: number, b: number, c: number) => void;
-    readonly wasm_bindgen__convert__closures________invoke__h30d0c5bc2814504b: (a: number, b: number, c: number) => void;
-    readonly wasm_bindgen__convert__closures________invoke__h30d0c5bc2814504b_568: (a: number, b: number, c: number) => void;
-    readonly wasm_bindgen__convert__closures________invoke__h30d0c5bc2814504b_644: (a: number, b: number, c: number) => void;
-    readonly wasm_bindgen__convert__closures________invoke__h30d0c5bc2814504b_868: (a: number, b: number, c: number) => void;
-    readonly wasm_bindgen__convert__closures________invoke__h3706817a15874f66: (a: number, b: number, c: number) => void;
-    readonly wasm_bindgen__convert__closures________invoke__h38e062983ccede17: (a: number, b: number, c: number) => void;
-    readonly wasm_bindgen__convert__closures________invoke__h3c436cce7474f8e8: (a: number, b: number, c: number) => void;
-    readonly wasm_bindgen__convert__closures________invoke__h3d3a2a426cc45453: (a: number, b: number, c: number) => void;
-    readonly wasm_bindgen__convert__closures________invoke__h3d3a2a426cc45453_792: (a: number, b: number, c: number) => void;
-    readonly wasm_bindgen__convert__closures________invoke__h5b31c0975da1d8ed: (a: number, b: number, c: number) => void;
-    readonly wasm_bindgen__convert__closures________invoke__h5b31c0975da1d8ed_668: (a: number, b: number, c: number) => void;
-    readonly wasm_bindgen__convert__closures________invoke__h5b31c0975da1d8ed_669: (a: number, b: number, c: number) => void;
-    readonly wasm_bindgen__convert__closures________invoke__h5d6da9d40bd8804c: (a: number, b: number, c: number) => void;
-    readonly wasm_bindgen__convert__closures________invoke__h5d6da9d40bd8804c_732: (a: number, b: number, c: number) => void;
-    readonly wasm_bindgen__convert__closures________invoke__h5d6da9d40bd8804c_791: (a: number, b: number, c: number) => void;
-    readonly wasm_bindgen__convert__closures________invoke__h5d6da9d40bd8804c_889: (a: number, b: number, c: number) => void;
-    readonly wasm_bindgen__convert__closures________invoke__h6c6557b4fddadffe: (a: number, b: number, c: number) => void;
-    readonly wasm_bindgen__convert__closures________invoke__h89e657239f6bc36c: (a: number, b: number, c: number) => void;
-    readonly wasm_bindgen__convert__closures________invoke__h998201a354f38134: (a: number, b: number, c: number) => void;
-    readonly wasm_bindgen__convert__closures________invoke__hb71984b94ba590b2: (a: number, b: number, c: number) => void;
-    readonly wasm_bindgen__convert__closures________invoke__hbfe4e1cb142ba9f5: (a: number, b: number, c: number) => void;
-    readonly wasm_bindgen__convert__closures________invoke__hd7a837444f609044: (a: number, b: number, c: number) => void;
-    readonly wasm_bindgen__convert__closures________invoke__he664acdc1ddfd511: (a: number, b: number, c: number) => void;
-    readonly wasm_bindgen__convert__closures________invoke__hff3050353ff8a4ac: (a: number, b: number, c: number) => void;
+    readonly wasm_bindgen__convert__closures________invoke__h0024b6a9725c74d1: (a: number, b: number, c: number) => void;
+    readonly wasm_bindgen__convert__closures________invoke__h05e337a8fc89f032: (a: number, b: number, c: number) => void;
+    readonly wasm_bindgen__convert__closures________invoke__h05e337a8fc89f032_731: (a: number, b: number, c: number) => void;
+    readonly wasm_bindgen__convert__closures________invoke__h05e337a8fc89f032_791: (a: number, b: number, c: number) => void;
+    readonly wasm_bindgen__convert__closures________invoke__h05e337a8fc89f032_889: (a: number, b: number, c: number) => void;
+    readonly wasm_bindgen__convert__closures________invoke__h081fca63452dae25: (a: number, b: number, c: number) => void;
+    readonly wasm_bindgen__convert__closures________invoke__h103e909415514a31: (a: number, b: number, c: number) => void;
+    readonly wasm_bindgen__convert__closures________invoke__h103e909415514a31_670: (a: number, b: number, c: number) => void;
+    readonly wasm_bindgen__convert__closures________invoke__h103e909415514a31_671: (a: number, b: number, c: number) => void;
+    readonly wasm_bindgen__convert__closures________invoke__h16b01965c5350264: (a: number, b: number, c: number) => void;
+    readonly wasm_bindgen__convert__closures________invoke__h207313b96d5846e6: (a: number, b: number, c: number) => void;
+    readonly wasm_bindgen__convert__closures________invoke__h207313b96d5846e6_567: (a: number, b: number, c: number) => void;
+    readonly wasm_bindgen__convert__closures________invoke__h207313b96d5846e6_644: (a: number, b: number, c: number) => void;
+    readonly wasm_bindgen__convert__closures________invoke__h207313b96d5846e6_868: (a: number, b: number, c: number) => void;
+    readonly wasm_bindgen__convert__closures________invoke__h2d240c68f8befdfe: (a: number, b: number, c: number) => void;
+    readonly wasm_bindgen__convert__closures________invoke__h38c6610736b9d5dc: (a: number, b: number, c: number) => void;
+    readonly wasm_bindgen__convert__closures________invoke__h4ecb9df32d78a2b3: (a: number, b: number, c: number) => void;
+    readonly wasm_bindgen__convert__closures________invoke__h4fcf1364a182fb42: (a: number, b: number, c: number) => void;
+    readonly wasm_bindgen__convert__closures________invoke__h573dfe2a6d5585e0: (a: number, b: number, c: number) => void;
+    readonly wasm_bindgen__convert__closures________invoke__h573dfe2a6d5585e0_792: (a: number, b: number, c: number) => void;
+    readonly wasm_bindgen__convert__closures________invoke__h5bd1bd76e83b4947: (a: number, b: number, c: number) => void;
+    readonly wasm_bindgen__convert__closures________invoke__h662c66095d361cd8: (a: number, b: number, c: number) => void;
+    readonly wasm_bindgen__convert__closures________invoke__h662c66095d361cd8_568: (a: number, b: number, c: number) => void;
+    readonly wasm_bindgen__convert__closures________invoke__h662c66095d361cd8_783: (a: number, b: number, c: number) => void;
+    readonly wasm_bindgen__convert__closures________invoke__h663e9b3ee533c02e: (a: number, b: number, c: number) => void;
+    readonly wasm_bindgen__convert__closures________invoke__h7d58772cccd67523: (a: number, b: number, c: number) => void;
+    readonly wasm_bindgen__convert__closures________invoke__h8a52274aa397b58d: (a: number, b: number, c: number) => void;
+    readonly wasm_bindgen__convert__closures________invoke__ha7574a1a10263082: (a: number, b: number, c: number) => void;
+    readonly wasm_bindgen__convert__closures________invoke__hf35a78df77702007: (a: number, b: number, c: number) => void;
     readonly __wbindgen_malloc: (a: number, b: number) => number;
     readonly __wbindgen_realloc: (a: number, b: number, c: number, d: number) => number;
     readonly __wbindgen_exn_store: (a: number) => void;