nmr-processing 11.5.0 → 11.5.1-pre.1699615423
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/nmr-processing.cjs +2 -2
- package/nmr-processing.d.ts +21 -3
- package/nmr-processing.mjs +2 -2
- package/package.json +2 -2
package/nmr-processing.d.ts
CHANGED
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@@ -14,6 +14,7 @@ import { Molecule } from 'openchemlib/full';
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14
14
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import { NmrData1D } from 'cheminfo-types';
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import { NmrData2D } from 'cheminfo-types';
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import { NmrData2DContent } from 'cheminfo-types';
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+
import { NmrData2DFt } from 'cheminfo-types';
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import { Nuclei } from 'gyromagnetic-ratio';
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import { OCLMolecule } from 'cheminfo-types';
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import { OptimizePeaksOptions } from 'ml-gsd';
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@@ -282,13 +283,14 @@ declare type Entry1DApodizationFilter = Partial<Omit<Entry1D, 'info'>> & {
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data: Required<NmrData1D>;
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};
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285
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-
declare interface Entry2D {
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286
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declare interface Entry2D<T extends NmrData2D = NmrData2D> {
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id?: string;
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zones: Zones;
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info: Record<string, any>;
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+
customInfo?: Record<string, any>;
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originalInfo?: Record<string, any>;
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-
data:
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-
originalData?:
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data: T;
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originalData?: T;
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filters: Filter[];
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}
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@@ -2731,12 +2733,26 @@ export declare interface PeaksToXYOptions extends OptionsSG1D {
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export declare function peakToXY(peak: NMRPeak1D, options: PeaksToXYOptions): DataXY<Float64Array>;
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2736
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declare interface PhaseCorrectionHorizontalOptions {
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2737
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ph0: number;
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ph1: number;
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}
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export declare interface PhaseCorrectionParameters {
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ph0: number;
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ph1: number;
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absolute: boolean;
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}
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export declare interface PhaseCorrectionTwoDOptions {
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horizontal?: PhaseCorrectionHorizontalOptions;
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vertical?: PhaseCorrectionVerticalOptions;
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}
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declare type PhaseCorrectionVerticalOptions = PhaseCorrectionHorizontalOptions & {
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quad?: 'imag' | 'real';
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};
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+
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export declare interface PolynomialOptions {
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zones: BaselineCorrectionZone[];
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algorithm: 'polynomial';
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@@ -3761,6 +3777,8 @@ declare function unlink(range: Range_2, options?: UnlinkOptions): Range_2;
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getZones?: boolean;
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}
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export declare function xyzPhaseCorrection(data: NmrData2DFt, options: PhaseCorrectionTwoDOptions): NmrData2DFt;
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export declare interface ZeroFillingOptions {
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nbPoints?: number;
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factor?: number;
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