From be0fea1e13f8078d8bd361b7006a3c2ad9500cdc Mon Sep 17 00:00:00 2001 From: jobo322 Date: Thu, 19 Oct 2023 07:55:53 -0500 Subject: [PATCH] chore: symmetrize cosy --- package-lock.json | 18 ++++---- package.json | 4 +- public/data/oxfordInstruments/oxfordCosy.json | 41 +++++++++++++++++++ 3 files changed, 52 insertions(+), 11 deletions(-) diff --git a/package-lock.json b/package-lock.json index afc7f7067a..6ddb7a0298 100644 --- a/package-lock.json +++ b/package-lock.json @@ -39,8 +39,8 @@ "ml-stat": "^1.3.3", "multiplet-analysis": "^2.1.2", "nmr-correlation": "^2.3.3", - "nmr-load-save": "0.21.1-pre.1696521357", - "nmr-processing": "^11.2.0", + "nmr-load-save": "^0.22.2", + "nmr-processing": "^11.3.0", "nmredata": "^0.9.7", "numeral": "^2.0.6", "openchemlib": "^8.5.0", @@ -9392,16 +9392,16 @@ } }, "node_modules/nmr-load-save": { - "version": "0.21.1-pre.1696521357", - "resolved": "https://registry.npmjs.org/nmr-load-save/-/nmr-load-save-0.21.1-pre.1696521357.tgz", - "integrity": "sha512-expP5BwnjQhA9muBu1T2itIbdCRJSxLhtih49vWup1SksWw5woKVsxfF1oZXSJbpmBxk9OrRrqCLwOJyCjJ2Lw==", + "version": "0.22.2", + "resolved": "https://registry.npmjs.org/nmr-load-save/-/nmr-load-save-0.22.2.tgz", + "integrity": "sha512-vWz0DHsb5Nppr0AH0T+bEs6XVww20nHDuKzTFTsZL3cBgaHMR2qA8R6LSn4tgt6XH5zZ83Q6nWh5K2n7UkNuDA==", "dependencies": { "@lukeed/uuid": "^2.0.1", "@types/lodash.merge": "^4.6.7", "brukerconverter": "^6.3.1", "cheminfo-types": "^1.7.2", "convert-to-jcamp": "^5.4.9", - "filelist-utils": "^1.10.1", + "filelist-utils": "^1.10.2", "gyromagnetic-ratio": "^1.0.0", "is-any-array": "^2.0.1", "jcampconverter": "^9.2.2", @@ -9409,10 +9409,10 @@ "lodash.merge": "^4.6.2", "ml-spectra-processing": "^12.5.1", "nmr-correlation": "^2.3.3", - "nmr-processing": "^11.2.0", + "nmr-processing": "^11.3.0", "nmredata": "^0.9.7", - "openchemlib": "^8.5.0", - "openchemlib-utils": "^5.2.0", + "openchemlib": "^8.7.0", + "openchemlib-utils": "^5.4.0", "sdf-parser": "^6.0.1", "varian-converter": "^0.3.3" } diff --git a/package.json b/package.json index ddfc2b3299..9b3e05107a 100644 --- a/package.json +++ b/package.json @@ -86,8 +86,8 @@ "ml-stat": "^1.3.3", "multiplet-analysis": "^2.1.2", "nmr-correlation": "^2.3.3", - "nmr-load-save": "0.21.1-pre.1696521357", - "nmr-processing": "^11.2.0", + "nmr-load-save": "^0.22.2", + "nmr-processing": "^11.3.0", "nmredata": "^0.9.7", "numeral": "^2.0.6", "openchemlib": "^8.5.0", diff --git a/public/data/oxfordInstruments/oxfordCosy.json b/public/data/oxfordInstruments/oxfordCosy.json index c32996dd3f..4556fbc535 100644 --- a/public/data/oxfordInstruments/oxfordCosy.json +++ b/public/data/oxfordInstruments/oxfordCosy.json @@ -40,13 +40,54 @@ ] }, "apply": true + }, + "zeroFilling": { + "nbPoints": 2048 + }, + "phaseCorrection": { + "mode": "mc" } }, "flag": true, "isDeleteAllow": true }, + { + "name": "flpDimension2", + "value": {}, + "flag": true, + "isDeleteAllow": true + }, { "name": "fftDimension2", + "value": { + "apodization": { + "compose": { + "shapes": [ + { + "shape": { + "kind": "sineBell", + "options": { + "offset": 0, + "exponent": 2 + } + } + } + ] + }, + "apply": true + }, + "zeroFilling": { + "nbPoints": 2048 + }, + "phaseCorrection": { + "mode": "mc" + } + }, + "flag": true, + "isDeleteAllow": true + }, + { + "name": "symmetrizeCosyLike", "value": {}, "flag": true, "isDeleteAllow": true