From e3c0df297e7ec9def4069f0ccb7d66eb573627dc Mon Sep 17 00:00:00 2001 From: jobo322 Date: Thu, 21 Sep 2023 01:06:39 -0500 Subject: [PATCH 1/5] chore: fix nmredata sample test --- ...d_J.nmredata => menthol_1D_1H_assigned_J.zip} | Bin public/data/nmredata/nmredata.json | 15 ++++++++++----- 2 files changed, 10 insertions(+), 5 deletions(-) rename public/data/nmredata/{menthol_1D_1H_assigned_J.nmredata => menthol_1D_1H_assigned_J.zip} (100%) diff --git a/public/data/nmredata/menthol_1D_1H_assigned_J.nmredata b/public/data/nmredata/menthol_1D_1H_assigned_J.zip similarity index 100% rename from public/data/nmredata/menthol_1D_1H_assigned_J.nmredata rename to public/data/nmredata/menthol_1D_1H_assigned_J.zip diff --git a/public/data/nmredata/nmredata.json b/public/data/nmredata/nmredata.json index 141af1570..b6cdff0dc 100644 --- a/public/data/nmredata/nmredata.json +++ b/public/data/nmredata/nmredata.json @@ -4,10 +4,7 @@ "baseURL": "", "entries": [ { - "name": "menthol_1D_1H_assigned_J.nmredata", - "size": 1, - "relativePath": "data/nmredata/menthol_1D_1H_assigned_J.nmredata", - "lastModified": 0 + "relativePath": "data/nmredata/menthol_1D_1H_assigned_J.zip", } ] }, @@ -15,7 +12,15 @@ { "sourceSelector": { "files": [ - "data/nmredata/menthol_1D_1H_assigned_J.nmredata" + "data/nmredata/menthol_1D_1H_assigned_J.zip/AN-menthol/10/acqu", + "data/nmredata/menthol_1D_1H_assigned_J.zip/AN-menthol/10/acqus", + "data/nmredata/menthol_1D_1H_assigned_J.zip/AN-menthol/10/fid", + "data/nmredata/menthol_1D_1H_assigned_J.zip/AN-menthol/10/pdata/1/1i", + "data/nmredata/menthol_1D_1H_assigned_J.zip/AN-menthol/10/pdata/1/1r", + "data/nmredata/menthol_1D_1H_assigned_J.zip/AN-menthol/10/pdata/1/proc", + "data/nmredata/menthol_1D_1H_assigned_J.zip/AN-menthol/10/pdata/1/procs", + "data/nmredata/menthol_1D_1H_assigned_J.zip/compound1_with_jcamp.nmredata.sdf", + "data/nmredata/menthol_1D_1H_assigned_J.zip/jcamp_nmr_spectra/1d1h.jcamp" ] } } From 2c38bd01b07557d77bacdd7fd0e3625997ae839c Mon Sep 17 00:00:00 2001 From: jobo322 Date: Thu, 21 Sep 2023 01:08:10 -0500 Subject: [PATCH 2/5] chore: fix json nmredata --- public/data/nmredata/nmredata.json | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/public/data/nmredata/nmredata.json b/public/data/nmredata/nmredata.json index b6cdff0dc..e86178b9e 100644 --- a/public/data/nmredata/nmredata.json +++ b/public/data/nmredata/nmredata.json @@ -4,7 +4,7 @@ "baseURL": "", "entries": [ { - "relativePath": "data/nmredata/menthol_1D_1H_assigned_J.zip", + "relativePath": "data/nmredata/menthol_1D_1H_assigned_J.zip" } ] }, From d6397d4ef4a2e24f3787d3875a2fcb006976272c Mon Sep 17 00:00:00 2001 From: jobo322 Date: Thu, 21 Sep 2023 08:10:49 -0500 Subject: [PATCH 3/5] chore: remove fid from nmredata sample test --- public/data/nmredata/nmredata.json | 1 - 1 file changed, 1 deletion(-) diff --git a/public/data/nmredata/nmredata.json b/public/data/nmredata/nmredata.json index e86178b9e..b85a93c64 100644 --- a/public/data/nmredata/nmredata.json +++ b/public/data/nmredata/nmredata.json @@ -14,7 +14,6 @@ "files": [ "data/nmredata/menthol_1D_1H_assigned_J.zip/AN-menthol/10/acqu", "data/nmredata/menthol_1D_1H_assigned_J.zip/AN-menthol/10/acqus", - "data/nmredata/menthol_1D_1H_assigned_J.zip/AN-menthol/10/fid", "data/nmredata/menthol_1D_1H_assigned_J.zip/AN-menthol/10/pdata/1/1i", "data/nmredata/menthol_1D_1H_assigned_J.zip/AN-menthol/10/pdata/1/1r", "data/nmredata/menthol_1D_1H_assigned_J.zip/AN-menthol/10/pdata/1/proc", From 9d8ac960778762356b7609bfd54efd68343d6461 Mon Sep 17 00:00:00 2001 From: jobo322 Date: Thu, 21 Sep 2023 11:33:11 -0500 Subject: [PATCH 4/5] chore: use nmredata extension in sample test --- ....zip => menthol_1D_1H_assigned_J.nmredata} | Bin public/data/nmredata/nmredata.json | 18 +++++++++--------- 2 files changed, 9 insertions(+), 9 deletions(-) rename public/data/nmredata/{menthol_1D_1H_assigned_J.zip => menthol_1D_1H_assigned_J.nmredata} (100%) diff --git a/public/data/nmredata/menthol_1D_1H_assigned_J.zip b/public/data/nmredata/menthol_1D_1H_assigned_J.nmredata similarity index 100% rename from public/data/nmredata/menthol_1D_1H_assigned_J.zip rename to public/data/nmredata/menthol_1D_1H_assigned_J.nmredata diff --git a/public/data/nmredata/nmredata.json b/public/data/nmredata/nmredata.json index b85a93c64..889852715 100644 --- a/public/data/nmredata/nmredata.json +++ b/public/data/nmredata/nmredata.json @@ -4,7 +4,7 @@ "baseURL": "", "entries": [ { - "relativePath": "data/nmredata/menthol_1D_1H_assigned_J.zip" + "relativePath": "data/nmredata/menthol_1D_1H_assigned_J.nmredata" } ] }, @@ -12,14 +12,14 @@ { "sourceSelector": { "files": [ - "data/nmredata/menthol_1D_1H_assigned_J.zip/AN-menthol/10/acqu", - "data/nmredata/menthol_1D_1H_assigned_J.zip/AN-menthol/10/acqus", - "data/nmredata/menthol_1D_1H_assigned_J.zip/AN-menthol/10/pdata/1/1i", - "data/nmredata/menthol_1D_1H_assigned_J.zip/AN-menthol/10/pdata/1/1r", - "data/nmredata/menthol_1D_1H_assigned_J.zip/AN-menthol/10/pdata/1/proc", - "data/nmredata/menthol_1D_1H_assigned_J.zip/AN-menthol/10/pdata/1/procs", - "data/nmredata/menthol_1D_1H_assigned_J.zip/compound1_with_jcamp.nmredata.sdf", - "data/nmredata/menthol_1D_1H_assigned_J.zip/jcamp_nmr_spectra/1d1h.jcamp" + "data/nmredata/menthol_1D_1H_assigned_J.nmredata/AN-menthol/10/acqu", + "data/nmredata/menthol_1D_1H_assigned_J.nmredata/AN-menthol/10/acqus", + "data/nmredata/menthol_1D_1H_assigned_J.nmredata/AN-menthol/10/pdata/1/1i", + "data/nmredata/menthol_1D_1H_assigned_J.nmredata/AN-menthol/10/pdata/1/1r", + "data/nmredata/menthol_1D_1H_assigned_J.nmredata/AN-menthol/10/pdata/1/proc", + "data/nmredata/menthol_1D_1H_assigned_J.nmredata/AN-menthol/10/pdata/1/procs", + "data/nmredata/menthol_1D_1H_assigned_J.nmredata/compound1_with_jcamp.nmredata.sdf", + "data/nmredata/menthol_1D_1H_assigned_J.nmredata/jcamp_nmr_spectra/1d1h.jcamp" ] } } From f2aa254c10f324d4a9f8940c5abe52cdec1e0db4 Mon Sep 17 00:00:00 2001 From: jobo322 Date: Fri, 6 Oct 2023 05:07:21 -0500 Subject: [PATCH 5/5] chore: stable release of nmr-load-save --- package-lock.json | 336 ---------------------------------------------- 1 file changed, 336 deletions(-) diff --git a/package-lock.json b/package-lock.json index debaaf1b8..694e0c1d7 100644 --- a/package-lock.json +++ b/package-lock.json @@ -1416,54 +1416,6 @@ "node": ">=16" } }, - 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