diff --git a/chromatopy/tools/analyzer.py b/chromatopy/tools/analyzer.py index 456ee64..21e8c5f 100644 --- a/chromatopy/tools/analyzer.py +++ b/chromatopy/tools/analyzer.py @@ -486,10 +486,15 @@ def read_agilent( ChromAnalyzer: ChromAnalyzer object containing the measurements. """ from chromatopy.readers.agilent_csv import AgilentCSVReader + from chromatopy.readers.agilent_rdl import AgilentRDLReader from chromatopy.readers.agilent_txt import AgilentTXTReader directory = Path(path) + txt_paths = [] + csv_paths = [] + rdl_paths = [] + txt_paths = [ str(f.absolute()) for f in directory.rglob("Report.TXT") @@ -500,6 +505,15 @@ def read_agilent( for f in directory.rglob("RESULTS.CSV") if f.parent.parent == directory ] + rdl_paths = [] + + try: + txt_path = next(directory.rglob("*.txt")) + lines = AgilentRDLReader.read_file(str(txt_path)) + if lines[0].startswith("┌─────"): + rdl_paths = [str(f.absolute()) for f in directory.rglob("*.txt")] + except StopIteration: + txt_paths = txt_paths data = { "dirpath": path, @@ -511,10 +525,13 @@ def read_agilent( "silent": silent, "mode": mode, } - - if not csv_paths and txt_paths: + if rdl_paths: + data["file_paths"] = rdl_paths # type: ignore + reader = AgilentRDLReader(**data) + measurements = reader.read() # type: ignore + elif not csv_paths and txt_paths: data["file_paths"] = txt_paths # type: ignore - reader = AgilentTXTReader(**data) + reader = AgilentTXTReader(**data) # type: ignore measurements = reader.read() # type: ignore elif csv_paths and not txt_paths: data["file_paths"] = csv_paths # type: ignore diff --git a/docs/examples/data/instances/shimadzu_analyzer.json b/docs/examples/data/instances/shimadzu_analyzer.json index 7b8ea06..bf794aa 100644 --- a/docs/examples/data/instances/shimadzu_analyzer.json +++ b/docs/examples/data/instances/shimadzu_analyzer.json @@ -18,7 +18,7 @@ "exponent": 1, "multiplier": 60.0, "scale": 1.0, - "ld_id": "chromatopy:BaseUnit/70a4517b-131a-450d-b527-1e8af2139815", + "ld_id": "chromatopy:BaseUnit/b33993a5-fcf1-4d7b-830e-ac12bb2fca19", "ld_type": [ "chromatopy:BaseUnit" ], @@ -36,7 +36,7 @@ } }, "data_type": "timecourse", - "ld_id": "chromatopy:Data/14fff5b2-0ca0-406c-9c68-e6054584e3bb", + "ld_id": "chromatopy:Data/1a0f9e45-6d5c-4418-837d-cd39af58c179", "ld_type": [ "chromatopy:Data" ], @@ -54,7 +54,7 @@ "exponent": 1, "multiplier": null, "scale": 1.0, - "ld_id": "chromatopy:BaseUnit/3b13d4af-ea69-4755-b635-651eeb8ba1e2", + "ld_id": "chromatopy:BaseUnit/0118c05d-1ffd-4771-9c7f-0c50d930000e", "ld_type": [ "chromatopy:BaseUnit" ], @@ -63,7 +63,7 @@ } } ], - "ld_id": "chromatopy:UnitDefinition/c11ca252-c8a2-48ce-8b8c-adef59b964c9", + "ld_id": "chromatopy:UnitDefinition/6b4c7713-3f5e-41b2-867f-2240f06c68a0", "ld_type": [ "OBO:UO_0000000" ], @@ -90,7 +90,7 @@ "separation_factor": 0.0, "peak_start": 0.017, "peak_end": 0.342, - "ld_id": "chromatopy:Peak/f71ccf23-9402-4b06-bfc2-8d4d4309d0e6", + "ld_id": "chromatopy:Peak/333bb403-2b5a-470f-8755-bfe89c00733b", "ld_type": [ "chromatopy:Peak" ], @@ -112,7 +112,7 @@ "separation_factor": 0.0, "peak_start": 2.6, "peak_end": 2.842, - "ld_id": "chromatopy:Peak/4bd69daa-0f23-4af3-a9eb-10ce4415f412", + "ld_id": "chromatopy:Peak/3c22f037-7b33-43a6-97a6-5d02cd2673d7", "ld_type": [ "chromatopy:Peak" ], @@ -134,7 +134,7 @@ "separation_factor": 1.172, "peak_start": 2.867, "peak_end": 3.492, - "ld_id": "chromatopy:Peak/2c59f649-61e4-440f-b0d6-47febe138b3f", + "ld_id": "chromatopy:Peak/ea89e291-d3f4-4ae8-bd27-f25f192a8281", "ld_type": [ "chromatopy:Peak" ], @@ -156,7 +156,7 @@ "separation_factor": 1.189, "peak_start": 3.492, "peak_end": 4.225, - "ld_id": "chromatopy:Peak/86e9b4a4-fdf4-4224-b2c0-b9f9464a841c", + "ld_id": "chromatopy:Peak/15c27ce0-2692-4e0a-bd55-4997eca7f90a", "ld_type": [ "chromatopy:Peak" ], @@ -178,7 +178,7 @@ "separation_factor": 1.246, "peak_start": 4.225, "peak_end": 4.858, - "ld_id": "chromatopy:Peak/35a1a6b3-932c-4a5d-858d-b15873e29356", + "ld_id": "chromatopy:Peak/1f341b81-38a9-4161-be38-7b644d8a8001", "ld_type": [ "chromatopy:Peak" ], @@ -200,7 +200,7 @@ "separation_factor": 1.164, "peak_start": 4.858, "peak_end": 6.025, - "ld_id": "chromatopy:Peak/5e0446c4-e620-4c6d-9cf4-037d90743297", + "ld_id": "chromatopy:Peak/e3c17f76-d984-4a60-a5ec-635d4c961fb1", "ld_type": [ "chromatopy:Peak" ], @@ -222,7 +222,7 @@ "separation_factor": 1.189, "peak_start": 6.025, "peak_end": 6.417, - "ld_id": "chromatopy:Peak/0c21d210-a1a2-4681-8c84-e8abe7a893e4", + "ld_id": "chromatopy:Peak/bf2f66fc-0439-49b3-814d-4a86964f49ef", "ld_type": [ "chromatopy:Peak" ], @@ -244,7 +244,7 @@ "separation_factor": 1.055, "peak_start": 6.417, "peak_end": 6.708, - "ld_id": "chromatopy:Peak/49f61f51-be9d-427a-99d2-df1775bbfc1f", + "ld_id": "chromatopy:Peak/d14732e3-7d71-4d89-a174-0dc8dc228189", "ld_type": [ "chromatopy:Peak" ], @@ -266,7 +266,7 @@ "separation_factor": 1.082, "peak_start": 6.708, "peak_end": 7.442, - "ld_id": "chromatopy:Peak/5f1d817e-ddea-40b6-a079-dec3cac92deb", + "ld_id": "chromatopy:Peak/efe5c1ba-2a4c-48e0-a7ed-e83abf2ba849", "ld_type": [ "chromatopy:Peak" ], @@ -288,7 +288,7 @@ "separation_factor": 1.138, "peak_start": 7.442, "peak_end": 8.95, - "ld_id": "chromatopy:Peak/fecf1350-3efc-47e3-972c-e52ca499b252", + "ld_id": "chromatopy:Peak/b9168c19-c9af-4961-b21c-f17fe49f15f3", "ld_type": [ "chromatopy:Peak" ], @@ -310,7 +310,7 @@ "separation_factor": 1.129, "peak_start": 8.95, "peak_end": 10.367, - "ld_id": "chromatopy:Peak/943ce441-21d3-463c-a639-1afa28be9752", + "ld_id": "chromatopy:Peak/53e82434-1ab3-4a97-829c-769a25bdc9ca", "ld_type": [ "chromatopy:Peak" ], @@ -332,7 +332,7 @@ "separation_factor": 1.146, "peak_start": 10.367, "peak_end": 11.067, - "ld_id": "chromatopy:Peak/e4262662-8e5e-41b0-8b4c-26a3b867e40b", + "ld_id": "chromatopy:Peak/b5998877-c723-4522-a685-c3af2a06c402", "ld_type": [ "chromatopy:Peak" ], @@ -354,7 +354,7 @@ "separation_factor": 1.098, "peak_start": 11.067, "peak_end": 12.442, - "ld_id": "chromatopy:Peak/f5fb762e-a571-48e8-b115-016c2e4e4ea8", + "ld_id": "chromatopy:Peak/c26c3525-a79e-4b04-bac4-95d463d5a116", "ld_type": [ "chromatopy:Peak" ], @@ -376,7 +376,7 @@ "separation_factor": 1.105, "peak_start": 12.442, "peak_end": 14.967, - "ld_id": "chromatopy:Peak/dcb14293-ab8f-47ef-85af-ca4c4dad8f0a", + "ld_id": "chromatopy:Peak/db040681-5e9d-40a2-ac95-85eecd66b5d0", "ld_type": [ "chromatopy:Peak" ], @@ -3993,7 +3993,7 @@ ], "processed_signal": [], "wavelength": 215.0, - "ld_id": "chromatopy:Chromatogram/b8f94e35-0d4e-4c04-aaab-6c9a14d4fcf9", + "ld_id": "chromatopy:Chromatogram/323b4818-afb1-46c0-bb6f-b3b75d58793d", "ld_type": [ "chromatopy:Chromatogram" ], @@ -4015,7 +4015,7 @@ "exponent": 1, "multiplier": null, "scale": -6.0, - "ld_id": "chromatopy:BaseUnit/a443f75a-3474-4861-b486-b7b6879f43bd", + "ld_id": "chromatopy:BaseUnit/0e8b73ef-30a4-4d88-953e-fbe0a1cba7b4", "ld_type": [ "chromatopy:BaseUnit" ], @@ -4032,7 +4032,7 @@ "chromatopy": "https://github.com/FAIRChemistry/chromatopy" } }, - "ld_id": "chromatopy:Measurement/dd8fca42-d094-4fd7-9da4-b1ca9a8a59c5", + "ld_id": "chromatopy:Measurement/3587a014-06e8-407d-a705-55ff062c65ea", "ld_type": [ "chromatopy:Measurement" ], @@ -4053,7 +4053,7 @@ "exponent": 1, "multiplier": 60.0, "scale": 1.0, - "ld_id": "chromatopy:BaseUnit/70a4517b-131a-450d-b527-1e8af2139815", + "ld_id": "chromatopy:BaseUnit/b33993a5-fcf1-4d7b-830e-ac12bb2fca19", "ld_type": [ "chromatopy:BaseUnit" ], @@ -4071,7 +4071,7 @@ } }, "data_type": "timecourse", - "ld_id": "chromatopy:Data/3a6c4ae2-ae4a-429b-97a9-cfaf3ed68cd3", + "ld_id": "chromatopy:Data/c153735f-31c6-4df6-bc4a-c20cb7ee334c", "ld_type": [ "chromatopy:Data" ], @@ -4089,7 +4089,7 @@ "exponent": 1, "multiplier": null, "scale": 1.0, - "ld_id": "chromatopy:BaseUnit/3b13d4af-ea69-4755-b635-651eeb8ba1e2", + "ld_id": "chromatopy:BaseUnit/0118c05d-1ffd-4771-9c7f-0c50d930000e", "ld_type": [ "chromatopy:BaseUnit" ], @@ -4098,7 +4098,7 @@ } } ], - "ld_id": "chromatopy:UnitDefinition/c11ca252-c8a2-48ce-8b8c-adef59b964c9", + "ld_id": "chromatopy:UnitDefinition/6b4c7713-3f5e-41b2-867f-2240f06c68a0", "ld_type": [ "OBO:UO_0000000" ], @@ -4125,7 +4125,7 @@ "separation_factor": 0.0, "peak_start": 0.017, "peak_end": 0.342, - "ld_id": "chromatopy:Peak/5325ed23-1ad7-4bf4-8b2a-9dea60608cca", + "ld_id": "chromatopy:Peak/f377c6e6-75e9-46bd-ad49-b19450fdc2c6", "ld_type": [ "chromatopy:Peak" ], @@ -4147,7 +4147,7 @@ "separation_factor": 0.0, "peak_start": 2.6, "peak_end": 2.842, - "ld_id": "chromatopy:Peak/bd454109-3caf-4d36-98e6-cf413de9402d", + "ld_id": "chromatopy:Peak/d23f9f87-eefe-47db-8e9f-2a2d67ff8c9d", "ld_type": [ "chromatopy:Peak" ], @@ -4169,7 +4169,7 @@ "separation_factor": 1.172, "peak_start": 2.867, "peak_end": 3.492, - "ld_id": "chromatopy:Peak/285c2f88-b8fa-4ca7-9649-4dd04e5f78f3", + "ld_id": "chromatopy:Peak/78573f03-bef1-4a01-9efc-2f9a90587d0e", "ld_type": [ "chromatopy:Peak" ], @@ -4191,7 +4191,7 @@ "separation_factor": 1.189, "peak_start": 3.492, "peak_end": 4.225, - "ld_id": "chromatopy:Peak/f4226095-5504-4cbd-ad8e-7e43736e5a66", + "ld_id": "chromatopy:Peak/3afcbd7a-6e55-44be-b12c-08d584918d58", "ld_type": [ "chromatopy:Peak" ], @@ -4213,7 +4213,7 @@ "separation_factor": 1.246, "peak_start": 4.225, "peak_end": 4.858, - "ld_id": "chromatopy:Peak/ef40644a-cb0c-4616-99f6-7a84d5c48a54", + "ld_id": "chromatopy:Peak/b8be9656-1419-496c-af9b-2a1832b181de", "ld_type": [ "chromatopy:Peak" ], @@ -4235,7 +4235,7 @@ "separation_factor": 1.164, "peak_start": 4.858, "peak_end": 6.025, - "ld_id": "chromatopy:Peak/230d9292-e4e7-4a38-8d0f-cbdbe5945877", + "ld_id": "chromatopy:Peak/1f42d2ca-8b6e-4c6e-8646-3054ec0d6e02", "ld_type": [ "chromatopy:Peak" ], @@ -4257,7 +4257,7 @@ "separation_factor": 1.189, "peak_start": 6.025, "peak_end": 6.417, - "ld_id": "chromatopy:Peak/773661a4-7d2a-4704-b16f-ba099f14a69e", + "ld_id": "chromatopy:Peak/9a9fa16d-13d7-423d-afa2-71eee29244c1", "ld_type": [ "chromatopy:Peak" ], @@ -4279,7 +4279,7 @@ "separation_factor": 1.055, "peak_start": 6.417, "peak_end": 6.708, - "ld_id": "chromatopy:Peak/bf403d86-a440-4e8c-9d6e-2187d952ef3b", + "ld_id": "chromatopy:Peak/cc1ca90b-9a8b-4038-a212-b125c3806950", "ld_type": [ "chromatopy:Peak" ], @@ -4301,7 +4301,7 @@ "separation_factor": 1.082, "peak_start": 6.708, "peak_end": 7.442, - "ld_id": "chromatopy:Peak/ea26b3ed-e4ee-4f58-aa76-8f2b1f71e910", + "ld_id": "chromatopy:Peak/d0bb1b0f-4f9e-401e-91e8-c3336d703050", "ld_type": [ "chromatopy:Peak" ], @@ -4323,7 +4323,7 @@ "separation_factor": 1.138, "peak_start": 7.442, "peak_end": 8.95, - "ld_id": "chromatopy:Peak/21f085bc-db65-42bd-9b42-a2bc71b31929", + "ld_id": "chromatopy:Peak/4c8ba806-3b34-4e6a-b074-3a7f217629ac", "ld_type": [ "chromatopy:Peak" ], @@ -4345,7 +4345,7 @@ "separation_factor": 1.129, "peak_start": 8.95, "peak_end": 10.367, - "ld_id": "chromatopy:Peak/963ca453-558b-4003-9ff8-5fd353f2e2b4", + "ld_id": "chromatopy:Peak/9908a925-eb0f-4b07-afe0-6c955e9325b6", "ld_type": [ "chromatopy:Peak" ], @@ -4367,7 +4367,7 @@ "separation_factor": 1.146, "peak_start": 10.367, "peak_end": 11.067, - "ld_id": "chromatopy:Peak/629741da-517e-446d-9a30-56ad4fdc7e42", + "ld_id": "chromatopy:Peak/245d861e-89f4-4ce9-ac24-9fb40307a9b6", "ld_type": [ "chromatopy:Peak" ], @@ -4389,7 +4389,7 @@ "separation_factor": 1.098, "peak_start": 11.067, "peak_end": 12.442, - "ld_id": "chromatopy:Peak/af681864-3c6c-4acd-bc9b-0271a4416e17", + "ld_id": "chromatopy:Peak/9a76913a-9333-476f-a991-d09a6edd7f61", "ld_type": [ "chromatopy:Peak" ], @@ -4411,7 +4411,7 @@ "separation_factor": 1.105, "peak_start": 12.442, "peak_end": 14.967, - "ld_id": "chromatopy:Peak/48ac368b-eef1-4295-856c-5619d2a3b304", + "ld_id": "chromatopy:Peak/0223a11b-ca7f-4b7d-94dc-849bc56a69f7", "ld_type": [ "chromatopy:Peak" ], @@ -8028,7 +8028,7 @@ ], "processed_signal": [], "wavelength": 215.0, - "ld_id": "chromatopy:Chromatogram/e5d09833-2118-448e-bea4-c52b98f6ee6b", + "ld_id": "chromatopy:Chromatogram/485dbf42-537b-4ed5-a61c-78060677a5eb", "ld_type": [ "chromatopy:Chromatogram" ], @@ -8050,7 +8050,7 @@ "exponent": 1, "multiplier": null, "scale": -6.0, - "ld_id": "chromatopy:BaseUnit/a443f75a-3474-4861-b486-b7b6879f43bd", + "ld_id": "chromatopy:BaseUnit/0e8b73ef-30a4-4d88-953e-fbe0a1cba7b4", "ld_type": [ "chromatopy:BaseUnit" ], @@ -8067,7 +8067,7 @@ "chromatopy": "https://github.com/FAIRChemistry/chromatopy" } }, - "ld_id": "chromatopy:Measurement/99ce7b05-56fa-4fff-8baa-88456020def5", + "ld_id": "chromatopy:Measurement/900d4756-5357-42d6-ac71-41340e1be3ee", "ld_type": [ "chromatopy:Measurement" ], @@ -8088,7 +8088,7 @@ "exponent": 1, "multiplier": 60.0, "scale": 1.0, - "ld_id": "chromatopy:BaseUnit/70a4517b-131a-450d-b527-1e8af2139815", + "ld_id": "chromatopy:BaseUnit/b33993a5-fcf1-4d7b-830e-ac12bb2fca19", "ld_type": [ "chromatopy:BaseUnit" ], @@ -8106,7 +8106,7 @@ } }, "data_type": "timecourse", - "ld_id": "chromatopy:Data/ffe9770b-8064-486c-8b55-ab36e4f64f95", + "ld_id": "chromatopy:Data/06190a4a-3347-4573-9eb7-ff39b81f437f", "ld_type": [ "chromatopy:Data" ], @@ -8124,7 +8124,7 @@ "exponent": 1, "multiplier": null, "scale": 1.0, - "ld_id": "chromatopy:BaseUnit/3b13d4af-ea69-4755-b635-651eeb8ba1e2", + "ld_id": "chromatopy:BaseUnit/0118c05d-1ffd-4771-9c7f-0c50d930000e", "ld_type": [ "chromatopy:BaseUnit" ], @@ -8133,7 +8133,7 @@ } } ], - "ld_id": "chromatopy:UnitDefinition/c11ca252-c8a2-48ce-8b8c-adef59b964c9", + "ld_id": "chromatopy:UnitDefinition/6b4c7713-3f5e-41b2-867f-2240f06c68a0", "ld_type": [ "OBO:UO_0000000" ], @@ -8160,7 +8160,7 @@ "separation_factor": 0.0, "peak_start": 0.017, "peak_end": 0.342, - "ld_id": "chromatopy:Peak/3f8b00fc-d97a-4889-9cc4-f37b3cbc2960", + "ld_id": "chromatopy:Peak/de6d26ba-0192-4745-9014-9862b786ae85", "ld_type": [ "chromatopy:Peak" ], @@ -8182,7 +8182,7 @@ "separation_factor": 0.0, "peak_start": 2.6, "peak_end": 2.842, - "ld_id": "chromatopy:Peak/4b51f678-6b6e-41ce-b372-afe0595124ce", + "ld_id": "chromatopy:Peak/463e38f7-621b-451b-a025-47d80823a86d", "ld_type": [ "chromatopy:Peak" ], @@ -8204,7 +8204,7 @@ "separation_factor": 1.172, "peak_start": 2.867, "peak_end": 3.492, - "ld_id": "chromatopy:Peak/558fe30d-0605-4ed2-a0f2-c8c261594861", + "ld_id": "chromatopy:Peak/8a1c5d54-29a1-4299-9143-0bfe86b75b72", "ld_type": [ "chromatopy:Peak" ], @@ -8226,7 +8226,7 @@ "separation_factor": 1.189, "peak_start": 3.492, "peak_end": 4.225, - "ld_id": "chromatopy:Peak/dcf84561-318d-41f7-8b4d-15e9fe98ad61", + "ld_id": "chromatopy:Peak/c5617a15-0fa1-450a-a2ff-19752f7497ed", "ld_type": [ "chromatopy:Peak" ], @@ -8248,7 +8248,7 @@ "separation_factor": 1.246, "peak_start": 4.225, "peak_end": 4.858, - "ld_id": "chromatopy:Peak/295d9989-afa8-4d9c-b394-ace94934435f", + "ld_id": "chromatopy:Peak/b55212e8-bf72-48e4-a620-e3c1e7665373", "ld_type": [ "chromatopy:Peak" ], @@ -8270,7 +8270,7 @@ "separation_factor": 1.164, "peak_start": 4.858, "peak_end": 6.025, - "ld_id": "chromatopy:Peak/436c7ba0-a186-4a5d-a2ad-7df4619dd0e6", + "ld_id": "chromatopy:Peak/7522a150-a821-415c-aeb8-40db4cdf5514", "ld_type": [ "chromatopy:Peak" ], @@ -8292,7 +8292,7 @@ "separation_factor": 1.189, "peak_start": 6.025, "peak_end": 6.417, - "ld_id": "chromatopy:Peak/6c3c1cd4-ca19-428b-837f-2d4105dc6f2f", + "ld_id": "chromatopy:Peak/6be1218b-b5cc-4f2f-a511-7908f2320309", "ld_type": [ "chromatopy:Peak" ], @@ -8314,7 +8314,7 @@ "separation_factor": 1.055, "peak_start": 6.417, "peak_end": 6.708, - "ld_id": "chromatopy:Peak/fb6bf417-2468-4bb4-b8b7-50df800cd1eb", + "ld_id": "chromatopy:Peak/08de8897-e561-4571-8e9d-c2ea7a1d507c", "ld_type": [ "chromatopy:Peak" ], @@ -8336,7 +8336,7 @@ "separation_factor": 1.082, "peak_start": 6.708, "peak_end": 7.442, - "ld_id": "chromatopy:Peak/5255cea1-f4d1-4a46-ac90-25bccf6c6672", + "ld_id": "chromatopy:Peak/a47c053f-ecf6-4a3b-a360-d5102cc07cf3", "ld_type": [ "chromatopy:Peak" ], @@ -8358,7 +8358,7 @@ "separation_factor": 1.138, "peak_start": 7.442, "peak_end": 8.95, - "ld_id": "chromatopy:Peak/e8d954e5-4468-4d10-8940-d9f6c1e58d39", + "ld_id": "chromatopy:Peak/30d12421-d2c4-4fb2-b62a-baaaae0f32a3", "ld_type": [ "chromatopy:Peak" ], @@ -8380,7 +8380,7 @@ "separation_factor": 1.129, "peak_start": 8.95, "peak_end": 10.367, - "ld_id": "chromatopy:Peak/139bd422-a1ad-441f-8ee5-a57d038f36eb", + "ld_id": "chromatopy:Peak/3d6d5372-c028-480f-99e7-e4efd5f084a3", "ld_type": [ "chromatopy:Peak" ], @@ -8402,7 +8402,7 @@ "separation_factor": 1.146, "peak_start": 10.367, "peak_end": 11.067, - "ld_id": "chromatopy:Peak/ddbdec95-8fce-42dc-919a-09b4998ecc55", + "ld_id": "chromatopy:Peak/f52486d2-b51e-4928-9547-4de5a871547e", "ld_type": [ "chromatopy:Peak" ], @@ -8424,7 +8424,7 @@ "separation_factor": 1.098, "peak_start": 11.067, "peak_end": 12.442, - "ld_id": "chromatopy:Peak/f18cee2a-123a-4298-9956-1ed48b855a18", + "ld_id": "chromatopy:Peak/653b2b17-e9cd-4360-b298-420cfdd40207", "ld_type": [ "chromatopy:Peak" ], @@ -8446,7 +8446,7 @@ "separation_factor": 1.105, "peak_start": 12.442, "peak_end": 14.967, - "ld_id": "chromatopy:Peak/227ca481-bc71-421c-a57a-ef9c699ed014", + "ld_id": "chromatopy:Peak/7267b4ea-0f2f-46b2-962a-593f4308758d", "ld_type": [ "chromatopy:Peak" ], @@ -12063,7 +12063,7 @@ ], "processed_signal": [], "wavelength": 215.0, - "ld_id": "chromatopy:Chromatogram/76f55004-e7c8-4313-85e2-97550f817c9a", + "ld_id": "chromatopy:Chromatogram/5dd2830c-9414-4c1b-b1fa-0bd90aa8125d", "ld_type": [ "chromatopy:Chromatogram" ], @@ -12085,7 +12085,7 @@ "exponent": 1, "multiplier": null, "scale": -6.0, - "ld_id": "chromatopy:BaseUnit/a443f75a-3474-4861-b486-b7b6879f43bd", + "ld_id": "chromatopy:BaseUnit/0e8b73ef-30a4-4d88-953e-fbe0a1cba7b4", "ld_type": [ "chromatopy:BaseUnit" ], @@ -12102,7 +12102,7 @@ "chromatopy": "https://github.com/FAIRChemistry/chromatopy" } }, - "ld_id": "chromatopy:Measurement/33618c77-27d0-4c27-85f6-337b0f97f5f4", + "ld_id": "chromatopy:Measurement/83816921-52db-407f-a9ad-cc20b6fe24a4", "ld_type": [ "chromatopy:Measurement" ], @@ -12123,7 +12123,7 @@ "exponent": 1, "multiplier": 60.0, "scale": 1.0, - "ld_id": "chromatopy:BaseUnit/70a4517b-131a-450d-b527-1e8af2139815", + "ld_id": "chromatopy:BaseUnit/b33993a5-fcf1-4d7b-830e-ac12bb2fca19", "ld_type": [ "chromatopy:BaseUnit" ], @@ -12141,7 +12141,7 @@ } }, "data_type": "timecourse", - "ld_id": "chromatopy:Data/d02f91cd-2b7f-4f95-b08a-25e73476fcb3", + "ld_id": "chromatopy:Data/6ae41640-6fd9-4192-89d5-334b03930ce7", "ld_type": [ "chromatopy:Data" ], @@ -12159,7 +12159,7 @@ "exponent": 1, "multiplier": null, "scale": 1.0, - "ld_id": "chromatopy:BaseUnit/3b13d4af-ea69-4755-b635-651eeb8ba1e2", + "ld_id": "chromatopy:BaseUnit/0118c05d-1ffd-4771-9c7f-0c50d930000e", "ld_type": [ "chromatopy:BaseUnit" ], @@ -12168,7 +12168,7 @@ } } ], - "ld_id": "chromatopy:UnitDefinition/c11ca252-c8a2-48ce-8b8c-adef59b964c9", + "ld_id": "chromatopy:UnitDefinition/6b4c7713-3f5e-41b2-867f-2240f06c68a0", "ld_type": [ "OBO:UO_0000000" ], @@ -12195,7 +12195,7 @@ "separation_factor": 0.0, "peak_start": 0.017, "peak_end": 0.342, - "ld_id": "chromatopy:Peak/e9bfd575-bd6b-4fee-8f16-8aa74ec53b97", + "ld_id": "chromatopy:Peak/4e67c046-f2d7-43a2-8cb9-1fd8c270d4ee", "ld_type": [ "chromatopy:Peak" ], @@ -12217,7 +12217,7 @@ "separation_factor": 0.0, "peak_start": 2.6, "peak_end": 2.842, - "ld_id": "chromatopy:Peak/48cae85d-bc9e-40f2-8bfb-60d7a514288e", + "ld_id": "chromatopy:Peak/1b3c9599-0171-40d1-b793-bab156ec9140", "ld_type": [ "chromatopy:Peak" ], @@ -12239,7 +12239,7 @@ "separation_factor": 1.172, "peak_start": 2.867, "peak_end": 3.492, - "ld_id": "chromatopy:Peak/bfb053af-3eeb-430a-8416-3b96fb5d9868", + "ld_id": "chromatopy:Peak/a9c16c9d-6598-4f93-a6b2-7f89e941a712", "ld_type": [ "chromatopy:Peak" ], @@ -12261,7 +12261,7 @@ "separation_factor": 1.189, "peak_start": 3.492, "peak_end": 4.225, - "ld_id": "chromatopy:Peak/02d3c3a7-b92e-48c8-aaad-ef2457f47f74", + "ld_id": "chromatopy:Peak/16408915-a63d-417e-acaf-87540367e6f4", "ld_type": [ "chromatopy:Peak" ], @@ -12283,7 +12283,7 @@ "separation_factor": 1.246, "peak_start": 4.225, "peak_end": 4.858, - "ld_id": "chromatopy:Peak/14bff6e8-3d4c-4e1d-a775-c55698973fd5", + "ld_id": "chromatopy:Peak/5a150314-e296-42a4-8bfc-d9a2b44bbec8", "ld_type": [ "chromatopy:Peak" ], @@ -12305,7 +12305,7 @@ "separation_factor": 1.164, "peak_start": 4.858, "peak_end": 6.025, - "ld_id": "chromatopy:Peak/84eedef5-fe58-46d3-851e-2371d27d263f", + "ld_id": "chromatopy:Peak/92306855-4153-4334-b1b0-11b93bf1ac62", "ld_type": [ "chromatopy:Peak" ], @@ -12327,7 +12327,7 @@ "separation_factor": 1.189, "peak_start": 6.025, "peak_end": 6.417, - "ld_id": "chromatopy:Peak/a9258e7f-0886-4add-be48-5230077174fc", + "ld_id": "chromatopy:Peak/73ebd53a-7c08-43c3-bff1-10a0e1c298a1", "ld_type": [ "chromatopy:Peak" ], @@ -12349,7 +12349,7 @@ "separation_factor": 1.055, "peak_start": 6.417, "peak_end": 6.708, - "ld_id": "chromatopy:Peak/0555be0d-c799-42c3-8c92-349ebeed8461", + "ld_id": "chromatopy:Peak/7374063e-8f15-49c8-9fc8-c18e9b1b08e6", "ld_type": [ "chromatopy:Peak" ], @@ -12371,7 +12371,7 @@ "separation_factor": 1.082, "peak_start": 6.708, "peak_end": 7.442, - "ld_id": "chromatopy:Peak/6d7e4daf-80d7-4fab-bd88-d61e4c2a26dd", + "ld_id": "chromatopy:Peak/23e98328-ad2b-4d49-bbd9-6e5ef8e622f2", "ld_type": [ "chromatopy:Peak" ], @@ -12393,7 +12393,7 @@ "separation_factor": 1.138, "peak_start": 7.442, "peak_end": 8.95, - "ld_id": "chromatopy:Peak/54cb53fb-06c5-4a2f-946d-b890a352f075", + "ld_id": "chromatopy:Peak/c185cadd-ed75-46a8-b48b-db802063105f", "ld_type": [ "chromatopy:Peak" ], @@ -12415,7 +12415,7 @@ "separation_factor": 1.129, "peak_start": 8.95, "peak_end": 10.367, - "ld_id": "chromatopy:Peak/3e02f909-773f-4633-9681-674486ca5d15", + "ld_id": "chromatopy:Peak/36d4ae6c-5061-4ae2-bc7e-8dde6744436e", "ld_type": [ "chromatopy:Peak" ], @@ -12437,7 +12437,7 @@ "separation_factor": 1.146, "peak_start": 10.367, "peak_end": 11.067, - "ld_id": "chromatopy:Peak/7bd0e3ff-7212-439e-8f8a-162e7a6e8e69", + "ld_id": "chromatopy:Peak/b5300558-a1d6-470d-b6c9-e031c80f8fa0", "ld_type": [ "chromatopy:Peak" ], @@ -12459,7 +12459,7 @@ "separation_factor": 1.098, "peak_start": 11.067, "peak_end": 12.442, - "ld_id": "chromatopy:Peak/67a8a1ce-d501-4074-9b16-31baceae37d4", + "ld_id": "chromatopy:Peak/515cce05-680e-4bf8-9f36-e558b20aed35", "ld_type": [ "chromatopy:Peak" ], @@ -12481,7 +12481,7 @@ "separation_factor": 1.105, "peak_start": 12.442, "peak_end": 14.967, - "ld_id": "chromatopy:Peak/f6fc4d3c-9d31-4428-a216-f8cca06215b5", + "ld_id": "chromatopy:Peak/2aa20d60-7728-4d00-b099-75cd236c4d57", "ld_type": [ "chromatopy:Peak" ], @@ -16098,7 +16098,7 @@ ], "processed_signal": [], "wavelength": 215.0, - "ld_id": "chromatopy:Chromatogram/d9b7e57e-757d-4322-9f1e-17badf3b64f4", + "ld_id": "chromatopy:Chromatogram/2816879b-1d0b-446e-a440-d6e6bb266380", "ld_type": [ "chromatopy:Chromatogram" ], @@ -16120,7 +16120,7 @@ "exponent": 1, "multiplier": null, "scale": -6.0, - "ld_id": "chromatopy:BaseUnit/a443f75a-3474-4861-b486-b7b6879f43bd", + "ld_id": "chromatopy:BaseUnit/0e8b73ef-30a4-4d88-953e-fbe0a1cba7b4", "ld_type": [ "chromatopy:BaseUnit" ], @@ -16137,7 +16137,7 @@ "chromatopy": "https://github.com/FAIRChemistry/chromatopy" } }, - "ld_id": "chromatopy:Measurement/df6e4389-ece0-4cbf-a322-d5f49186aa0d", + "ld_id": "chromatopy:Measurement/af40bd6f-e517-45f5-9d42-568dd451126b", "ld_type": [ "chromatopy:Measurement" ], @@ -16158,7 +16158,7 @@ "exponent": 1, "multiplier": 60.0, "scale": 1.0, - "ld_id": "chromatopy:BaseUnit/70a4517b-131a-450d-b527-1e8af2139815", + "ld_id": "chromatopy:BaseUnit/b33993a5-fcf1-4d7b-830e-ac12bb2fca19", "ld_type": [ "chromatopy:BaseUnit" ], @@ -16176,7 +16176,7 @@ } }, "data_type": "timecourse", - "ld_id": "chromatopy:Data/76757c71-72d9-4797-a371-1dd911238b3c", + "ld_id": "chromatopy:Data/c16bad87-a995-4d46-b808-a7ff3d2dec6b", "ld_type": [ "chromatopy:Data" ], @@ -16194,7 +16194,7 @@ "exponent": 1, "multiplier": null, "scale": 1.0, - "ld_id": "chromatopy:BaseUnit/3b13d4af-ea69-4755-b635-651eeb8ba1e2", + "ld_id": "chromatopy:BaseUnit/0118c05d-1ffd-4771-9c7f-0c50d930000e", "ld_type": [ "chromatopy:BaseUnit" ], @@ -16203,7 +16203,7 @@ } } ], - "ld_id": "chromatopy:UnitDefinition/c11ca252-c8a2-48ce-8b8c-adef59b964c9", + "ld_id": "chromatopy:UnitDefinition/6b4c7713-3f5e-41b2-867f-2240f06c68a0", "ld_type": [ "OBO:UO_0000000" ], @@ -16230,7 +16230,7 @@ "separation_factor": 0.0, "peak_start": 0.017, "peak_end": 0.342, - "ld_id": "chromatopy:Peak/6e3dad33-df73-4bd4-918d-e4728fa58230", + "ld_id": "chromatopy:Peak/5e8603b2-a39c-445c-a197-d2c84b596e9b", "ld_type": [ "chromatopy:Peak" ], @@ -16252,7 +16252,7 @@ "separation_factor": 0.0, "peak_start": 2.6, "peak_end": 2.842, - "ld_id": "chromatopy:Peak/ffaf7a61-2542-4181-adf4-603fcb39e728", + "ld_id": "chromatopy:Peak/52cd19ee-cc4d-4404-a135-7459e84f16c6", "ld_type": [ "chromatopy:Peak" ], @@ -16274,7 +16274,7 @@ "separation_factor": 1.172, "peak_start": 2.867, "peak_end": 3.492, - "ld_id": "chromatopy:Peak/40f98ee0-4a18-4029-8ef7-1f7790ef8c15", + "ld_id": "chromatopy:Peak/c2aa3f85-3a74-4845-a7d4-22785b4d68b2", "ld_type": [ "chromatopy:Peak" ], @@ -16296,7 +16296,7 @@ "separation_factor": 1.189, "peak_start": 3.492, "peak_end": 4.225, - "ld_id": "chromatopy:Peak/bfceaed2-cc50-426e-be2e-ebfc496d3b53", + "ld_id": "chromatopy:Peak/13aba518-a050-4e63-a3e8-ad783997271f", "ld_type": [ "chromatopy:Peak" ], @@ -16318,7 +16318,7 @@ "separation_factor": 1.246, "peak_start": 4.225, "peak_end": 4.858, - "ld_id": "chromatopy:Peak/a449d5b7-2c91-4a5d-a40e-fedd388e5848", + "ld_id": "chromatopy:Peak/d9712d4b-7559-4aef-9a8c-e6de40304bcb", "ld_type": [ "chromatopy:Peak" ], @@ -16340,7 +16340,7 @@ "separation_factor": 1.164, "peak_start": 4.858, "peak_end": 6.025, - "ld_id": "chromatopy:Peak/defbda77-bcf6-424f-bb9a-8cdb7e30baf2", + "ld_id": "chromatopy:Peak/4b5d1115-1cd9-4b0d-b6f8-891693d2d5f5", "ld_type": [ "chromatopy:Peak" ], @@ -16362,7 +16362,7 @@ "separation_factor": 1.189, "peak_start": 6.025, "peak_end": 6.417, - "ld_id": "chromatopy:Peak/3291f910-39d5-4755-9f80-ee72cc498639", + "ld_id": "chromatopy:Peak/d2529c5d-1a13-4ff3-8f53-8350bc6101e9", "ld_type": [ "chromatopy:Peak" ], @@ -16384,7 +16384,7 @@ "separation_factor": 1.055, "peak_start": 6.417, "peak_end": 6.708, - "ld_id": "chromatopy:Peak/31b0a69f-c5ec-47fa-b9a4-412876f5df0d", + "ld_id": "chromatopy:Peak/c81788e1-30b0-4736-8552-1c81c45f3466", "ld_type": [ "chromatopy:Peak" ], @@ -16406,7 +16406,7 @@ "separation_factor": 1.082, "peak_start": 6.708, "peak_end": 7.442, - "ld_id": "chromatopy:Peak/e188446c-4eee-486c-9a49-0d5b2427d30b", + "ld_id": "chromatopy:Peak/9e86dc54-aae4-4a98-ac41-92d3df88236b", "ld_type": [ "chromatopy:Peak" ], @@ -16428,7 +16428,7 @@ "separation_factor": 1.138, "peak_start": 7.442, "peak_end": 8.95, - "ld_id": "chromatopy:Peak/9924d281-0631-4d32-8b8f-b0b37fcff248", + "ld_id": "chromatopy:Peak/ade0e2c0-2c0c-457a-baca-335de7856be7", "ld_type": [ "chromatopy:Peak" ], @@ -16450,7 +16450,7 @@ "separation_factor": 1.129, "peak_start": 8.95, "peak_end": 10.367, - "ld_id": "chromatopy:Peak/effe5cd0-9420-4ac0-bd9f-a9d0fb459fcb", + "ld_id": "chromatopy:Peak/aae76d76-61a6-4652-a1f3-7b2af8fc9ebc", "ld_type": [ "chromatopy:Peak" ], @@ -16472,7 +16472,7 @@ "separation_factor": 1.146, "peak_start": 10.367, "peak_end": 11.067, - "ld_id": "chromatopy:Peak/d29a6c08-6856-498d-bb0c-11583b602bc1", + "ld_id": "chromatopy:Peak/743c3695-14e3-465a-ab93-0b10cc967b7c", "ld_type": [ "chromatopy:Peak" ], @@ -16494,7 +16494,7 @@ "separation_factor": 1.098, "peak_start": 11.067, "peak_end": 12.442, - "ld_id": "chromatopy:Peak/c936c687-88f6-43e9-a796-4d0e7b7df211", + "ld_id": "chromatopy:Peak/3c8a393e-0fed-46b4-8cb9-50ee7400007b", "ld_type": [ "chromatopy:Peak" ], @@ -16516,7 +16516,7 @@ "separation_factor": 1.105, "peak_start": 12.442, "peak_end": 14.967, - "ld_id": "chromatopy:Peak/c9f2c33c-1439-4518-8f2c-27762a8a3a72", + "ld_id": "chromatopy:Peak/ad066191-6e8f-4695-b77d-182765c34dfb", "ld_type": [ "chromatopy:Peak" ], @@ -20133,7 +20133,7 @@ ], "processed_signal": [], "wavelength": 215.0, - "ld_id": "chromatopy:Chromatogram/d12ad010-0cb6-44b8-b5bf-a6ae8010d3c2", + "ld_id": "chromatopy:Chromatogram/49bf06f0-c03e-496a-98da-9ed859dc662c", "ld_type": [ "chromatopy:Chromatogram" ], @@ -20155,7 +20155,7 @@ "exponent": 1, "multiplier": null, "scale": -6.0, - "ld_id": "chromatopy:BaseUnit/a443f75a-3474-4861-b486-b7b6879f43bd", + "ld_id": "chromatopy:BaseUnit/0e8b73ef-30a4-4d88-953e-fbe0a1cba7b4", "ld_type": [ "chromatopy:BaseUnit" ], @@ -20172,7 +20172,7 @@ "chromatopy": "https://github.com/FAIRChemistry/chromatopy" } }, - "ld_id": "chromatopy:Measurement/bebc162d-c356-4c0b-885d-89e0012bbd37", + "ld_id": "chromatopy:Measurement/069f3ad8-f159-4dce-aa85-8820f4999f65", "ld_type": [ "chromatopy:Measurement" ], @@ -20193,7 +20193,7 @@ "exponent": 1, "multiplier": 60.0, "scale": 1.0, - "ld_id": "chromatopy:BaseUnit/70a4517b-131a-450d-b527-1e8af2139815", + "ld_id": "chromatopy:BaseUnit/b33993a5-fcf1-4d7b-830e-ac12bb2fca19", "ld_type": [ "chromatopy:BaseUnit" ], @@ -20211,7 +20211,7 @@ } }, "data_type": "timecourse", - "ld_id": "chromatopy:Data/67b2239c-8800-4234-91ee-4896edb2f1a3", + "ld_id": "chromatopy:Data/fdaf8d57-08e1-4302-afd8-8c1a62c91e64", "ld_type": [ "chromatopy:Data" ], @@ -20229,7 +20229,7 @@ "exponent": 1, "multiplier": null, "scale": 1.0, - "ld_id": "chromatopy:BaseUnit/3b13d4af-ea69-4755-b635-651eeb8ba1e2", + "ld_id": "chromatopy:BaseUnit/0118c05d-1ffd-4771-9c7f-0c50d930000e", "ld_type": [ "chromatopy:BaseUnit" ], @@ -20238,7 +20238,7 @@ } } ], - "ld_id": "chromatopy:UnitDefinition/c11ca252-c8a2-48ce-8b8c-adef59b964c9", + "ld_id": "chromatopy:UnitDefinition/6b4c7713-3f5e-41b2-867f-2240f06c68a0", "ld_type": [ "OBO:UO_0000000" ], @@ -20265,7 +20265,7 @@ "separation_factor": 0.0, "peak_start": 0.017, "peak_end": 0.342, - "ld_id": "chromatopy:Peak/aa6fd208-fe02-490e-97fb-544c4f81e51a", + "ld_id": "chromatopy:Peak/a7e7ab1f-a6ff-4799-a1cd-e87c586f5eba", "ld_type": [ "chromatopy:Peak" ], @@ -20287,7 +20287,7 @@ "separation_factor": 0.0, "peak_start": 2.6, "peak_end": 2.842, - "ld_id": "chromatopy:Peak/7b0b469d-4728-4f90-bc57-dc61b495ba45", + "ld_id": "chromatopy:Peak/e6b64800-709c-42ce-af2a-4e8083a1bccf", "ld_type": [ "chromatopy:Peak" ], @@ -20309,7 +20309,7 @@ "separation_factor": 1.172, "peak_start": 2.867, "peak_end": 3.492, - "ld_id": "chromatopy:Peak/22df646d-ab38-4cbd-8994-cb3fea7b30ba", + "ld_id": "chromatopy:Peak/22425252-6bab-4f02-bdef-6293ae1a9706", "ld_type": [ "chromatopy:Peak" ], @@ -20331,7 +20331,7 @@ "separation_factor": 1.189, "peak_start": 3.492, "peak_end": 4.225, - "ld_id": "chromatopy:Peak/756ab71f-0aa6-4df3-bddd-4ebc01b052da", + "ld_id": "chromatopy:Peak/585c24e7-d97f-4631-aae2-fe0944c46b6b", "ld_type": [ "chromatopy:Peak" ], @@ -20353,7 +20353,7 @@ "separation_factor": 1.246, "peak_start": 4.225, "peak_end": 4.858, - "ld_id": "chromatopy:Peak/8a67e490-f156-4b92-92b9-27ed127ba65c", + "ld_id": "chromatopy:Peak/fcbf020d-8ce1-4489-b6b5-b24ba3a22fd4", "ld_type": [ "chromatopy:Peak" ], @@ -20375,7 +20375,7 @@ "separation_factor": 1.164, "peak_start": 4.858, "peak_end": 6.025, - "ld_id": "chromatopy:Peak/703b47ce-e9cb-4947-b359-a425c4288a74", + "ld_id": "chromatopy:Peak/1f15266e-814c-4ad2-a9a3-3d64f67064c7", "ld_type": [ "chromatopy:Peak" ], @@ -20397,7 +20397,7 @@ "separation_factor": 1.189, "peak_start": 6.025, "peak_end": 6.417, - "ld_id": "chromatopy:Peak/cab53603-f000-4fe1-bbf2-6b660654ab48", + "ld_id": "chromatopy:Peak/cbecba65-a98a-4117-989c-442d01dda155", "ld_type": [ "chromatopy:Peak" ], @@ -20419,7 +20419,7 @@ "separation_factor": 1.055, "peak_start": 6.417, "peak_end": 6.708, - "ld_id": "chromatopy:Peak/005189a7-332d-40a5-a54e-6e30af8671a3", + "ld_id": "chromatopy:Peak/8801a5a6-0f28-4eea-8b81-3ad944bc2490", "ld_type": [ "chromatopy:Peak" ], @@ -20441,7 +20441,7 @@ "separation_factor": 1.082, "peak_start": 6.708, "peak_end": 7.442, - "ld_id": "chromatopy:Peak/2aa88f6d-0a33-45d8-b673-bab0d621eddb", + "ld_id": "chromatopy:Peak/1465f672-64ea-4878-87b5-ef3f1e2b66e0", "ld_type": [ "chromatopy:Peak" ], @@ -20463,7 +20463,7 @@ "separation_factor": 1.138, "peak_start": 7.442, "peak_end": 8.95, - "ld_id": "chromatopy:Peak/cc6fb00a-5998-42df-bffb-c87f6280411e", + "ld_id": "chromatopy:Peak/54e6bca0-bf14-4763-918d-53794eeddef4", "ld_type": [ "chromatopy:Peak" ], @@ -20485,7 +20485,7 @@ "separation_factor": 1.129, "peak_start": 8.95, "peak_end": 10.367, - "ld_id": "chromatopy:Peak/fe6c4c12-7a04-4cfb-b756-d29d16c81316", + "ld_id": "chromatopy:Peak/76066fcc-7324-407b-b8a2-0165fac50142", "ld_type": [ "chromatopy:Peak" ], @@ -20507,7 +20507,7 @@ "separation_factor": 1.146, "peak_start": 10.367, "peak_end": 11.067, - "ld_id": "chromatopy:Peak/06509009-e652-485d-a9df-9029e4839d77", + "ld_id": "chromatopy:Peak/24bdedca-808e-4b29-b7a5-03eb48d38e37", "ld_type": [ "chromatopy:Peak" ], @@ -20529,7 +20529,7 @@ "separation_factor": 1.098, "peak_start": 11.067, "peak_end": 12.442, - "ld_id": "chromatopy:Peak/1ef1c390-6174-404d-aa01-f01f62b91796", + "ld_id": "chromatopy:Peak/31637122-5234-4c17-998a-b962cd6e5305", "ld_type": [ "chromatopy:Peak" ], @@ -20551,7 +20551,7 @@ "separation_factor": 1.105, "peak_start": 12.442, "peak_end": 14.967, - "ld_id": "chromatopy:Peak/5d920bb6-b82b-424f-9c30-a3433f920ce2", + "ld_id": "chromatopy:Peak/8dfd207b-1c53-4d44-a772-10268cc51818", "ld_type": [ "chromatopy:Peak" ], @@ -24168,7 +24168,7 @@ ], "processed_signal": [], "wavelength": 215.0, - "ld_id": "chromatopy:Chromatogram/aa894c5d-d251-4d9a-9ed8-d347ce277f87", + "ld_id": "chromatopy:Chromatogram/6337013b-5254-4618-b9aa-87e821e45b1d", "ld_type": [ "chromatopy:Chromatogram" ], @@ -24190,7 +24190,7 @@ "exponent": 1, "multiplier": null, "scale": -6.0, - "ld_id": "chromatopy:BaseUnit/a443f75a-3474-4861-b486-b7b6879f43bd", + "ld_id": "chromatopy:BaseUnit/0e8b73ef-30a4-4d88-953e-fbe0a1cba7b4", "ld_type": [ "chromatopy:BaseUnit" ], @@ -24207,7 +24207,7 @@ "chromatopy": "https://github.com/FAIRChemistry/chromatopy" } }, - "ld_id": "chromatopy:Measurement/41e162a4-a260-471b-bf81-cf948ed94802", + "ld_id": "chromatopy:Measurement/ceaf491b-3b84-4b9a-8e6e-d052fa3244b5", "ld_type": [ "chromatopy:Measurement" ], @@ -24228,7 +24228,7 @@ "exponent": 1, "multiplier": 60.0, "scale": 1.0, - "ld_id": "chromatopy:BaseUnit/70a4517b-131a-450d-b527-1e8af2139815", + "ld_id": "chromatopy:BaseUnit/b33993a5-fcf1-4d7b-830e-ac12bb2fca19", "ld_type": [ "chromatopy:BaseUnit" ], @@ -24246,7 +24246,7 @@ } }, "data_type": "timecourse", - "ld_id": "chromatopy:Data/355fb226-c728-46c2-8b7c-9c43276272a8", + "ld_id": "chromatopy:Data/75fe7277-f4aa-4291-9b2c-c76afc978d4c", "ld_type": [ "chromatopy:Data" ], @@ -24264,7 +24264,7 @@ "exponent": 1, "multiplier": null, "scale": 1.0, - "ld_id": "chromatopy:BaseUnit/3b13d4af-ea69-4755-b635-651eeb8ba1e2", + "ld_id": "chromatopy:BaseUnit/0118c05d-1ffd-4771-9c7f-0c50d930000e", "ld_type": [ "chromatopy:BaseUnit" ], @@ -24273,7 +24273,7 @@ } } ], - "ld_id": "chromatopy:UnitDefinition/c11ca252-c8a2-48ce-8b8c-adef59b964c9", + "ld_id": "chromatopy:UnitDefinition/6b4c7713-3f5e-41b2-867f-2240f06c68a0", "ld_type": [ "OBO:UO_0000000" ], @@ -24300,7 +24300,7 @@ "separation_factor": 0.0, "peak_start": 0.617, "peak_end": 1.033, - "ld_id": "chromatopy:Peak/2e407dc3-8231-43d9-8fbe-c53779b337ec", + "ld_id": "chromatopy:Peak/4f4e67ec-f779-46d3-ba98-d10f31caf5ff", "ld_type": [ "chromatopy:Peak" ], @@ -24322,7 +24322,7 @@ "separation_factor": 0.0, "peak_start": 3.008, "peak_end": 3.458, - "ld_id": "chromatopy:Peak/9e409e46-3489-40ba-aeff-0caac535e4f6", + "ld_id": "chromatopy:Peak/3e4131f7-88ef-49b2-914f-756ee63f84e5", "ld_type": [ "chromatopy:Peak" ], @@ -24344,7 +24344,7 @@ "separation_factor": 1.215, "peak_start": 3.458, "peak_end": 3.758, - "ld_id": "chromatopy:Peak/9764e40b-f7f3-4e97-8015-5b99fbe66180", + "ld_id": "chromatopy:Peak/9c995f50-8fb4-446c-9f88-4bc9cbbd4349", "ld_type": [ "chromatopy:Peak" ], @@ -24366,7 +24366,7 @@ "separation_factor": 1.105, "peak_start": 3.758, "peak_end": 4.958, - "ld_id": "chromatopy:Peak/8bce234c-6a3b-42f7-bc25-ba76e1a58a33", + "ld_id": "chromatopy:Peak/3432b6d2-88c6-4b2d-be34-5a6325267e79", "ld_type": [ "chromatopy:Peak" ], @@ -24388,7 +24388,7 @@ "separation_factor": 1.363, "peak_start": 4.958, "peak_end": 6.817, - "ld_id": "chromatopy:Peak/224e1738-24f3-4ead-8116-6dbd092640c8", + "ld_id": "chromatopy:Peak/cace6163-fc62-49a0-92b6-b5af3737274c", "ld_type": [ "chromatopy:Peak" ], @@ -24410,7 +24410,7 @@ "separation_factor": 1.419, "peak_start": 6.817, "peak_end": 7.642, - "ld_id": "chromatopy:Peak/d510c44e-3354-4fcc-a984-1705247b76ea", + "ld_id": "chromatopy:Peak/7a458a51-ad5c-48d6-9735-dc2a6ebe4e46", "ld_type": [ "chromatopy:Peak" ], @@ -24432,7 +24432,7 @@ "separation_factor": 1.136, "peak_start": 7.642, "peak_end": 9.083, - "ld_id": "chromatopy:Peak/47564cbf-fc31-4fc5-9a7a-7be072ef56ea", + "ld_id": "chromatopy:Peak/df5cbce4-ff13-45f3-8c1a-c595dcba8630", "ld_type": [ "chromatopy:Peak" ], @@ -24454,7 +24454,7 @@ "separation_factor": 1.187, "peak_start": 9.083, "peak_end": 10.708, - "ld_id": "chromatopy:Peak/a37d7d95-e100-42e8-8428-542055055e40", + "ld_id": "chromatopy:Peak/04b92a58-0a04-488f-9839-45ed20e9547b", "ld_type": [ "chromatopy:Peak" ], @@ -24476,7 +24476,7 @@ "separation_factor": 1.173, "peak_start": 10.708, "peak_end": 11.35, - "ld_id": "chromatopy:Peak/0581e127-b2b0-443f-bce5-b3aae0f65103", + "ld_id": "chromatopy:Peak/3160b902-6046-47bf-ac5e-40ff5f974517", "ld_type": [ "chromatopy:Peak" ], @@ -24498,7 +24498,7 @@ "separation_factor": 1.084, "peak_start": 11.35, "peak_end": 12.7, - "ld_id": "chromatopy:Peak/7b3c792a-29e1-4d72-aa21-e6f55d852407", + "ld_id": "chromatopy:Peak/a86bc6cd-3ece-423c-a9a3-76856cd5c7b7", "ld_type": [ "chromatopy:Peak" ], @@ -24520,7 +24520,7 @@ "separation_factor": 1.098, "peak_start": 12.7, "peak_end": 13.15, - "ld_id": "chromatopy:Peak/1ac327f5-0b67-47aa-89f9-385d7d0957a4", + "ld_id": "chromatopy:Peak/d99c3289-8066-4270-92d9-20d9ced7c54c", "ld_type": [ "chromatopy:Peak" ], @@ -24542,7 +24542,7 @@ "separation_factor": 1.019, "peak_start": 13.15, "peak_end": 13.233, - "ld_id": "chromatopy:Peak/7b6f2b61-f302-4e27-9f40-44b5b9193d45", + "ld_id": "chromatopy:Peak/6d2ce54f-f37e-4c56-aa20-bc3bfa72ea55", "ld_type": [ "chromatopy:Peak" ], @@ -24564,7 +24564,7 @@ "separation_factor": 1.022, "peak_start": 13.233, "peak_end": 14.325, - "ld_id": "chromatopy:Peak/9f704988-de5f-44bf-a61f-6e976b069389", + "ld_id": "chromatopy:Peak/1fbd74de-e02f-4fdb-b92c-2d6a8444d2b2", "ld_type": [ "chromatopy:Peak" ], @@ -24586,7 +24586,7 @@ "separation_factor": 1.084, "peak_start": 14.325, "peak_end": 14.725, - "ld_id": "chromatopy:Peak/70fdf0c8-d10b-4da2-b0be-b3d8773fd977", + "ld_id": "chromatopy:Peak/8d803541-4e28-4a4e-b2ff-66820c541d20", "ld_type": [ "chromatopy:Peak" ], @@ -28203,7 +28203,7 @@ ], "processed_signal": [], "wavelength": 215.0, - "ld_id": "chromatopy:Chromatogram/474866cc-ab6a-4b26-beec-b2d35c408b58", + "ld_id": "chromatopy:Chromatogram/1fded390-6ddc-48c2-8a01-df0000b433e9", "ld_type": [ "chromatopy:Chromatogram" ], @@ -28225,7 +28225,7 @@ "exponent": 1, "multiplier": null, "scale": -6.0, - "ld_id": "chromatopy:BaseUnit/a443f75a-3474-4861-b486-b7b6879f43bd", + "ld_id": "chromatopy:BaseUnit/0e8b73ef-30a4-4d88-953e-fbe0a1cba7b4", "ld_type": [ "chromatopy:BaseUnit" ], @@ -28242,7 +28242,7 @@ "chromatopy": "https://github.com/FAIRChemistry/chromatopy" } }, - "ld_id": "chromatopy:Measurement/70ef3c00-0ded-4ed4-a18e-c4b4addb7e26", + "ld_id": "chromatopy:Measurement/ed555bd5-d614-4bf5-85dc-85c7d1094c7d", "ld_type": [ "chromatopy:Measurement" ], @@ -28263,7 +28263,7 @@ "exponent": 1, "multiplier": 60.0, "scale": 1.0, - "ld_id": "chromatopy:BaseUnit/70a4517b-131a-450d-b527-1e8af2139815", + "ld_id": "chromatopy:BaseUnit/b33993a5-fcf1-4d7b-830e-ac12bb2fca19", "ld_type": [ "chromatopy:BaseUnit" ], @@ -28281,7 +28281,7 @@ } }, "data_type": "timecourse", - "ld_id": "chromatopy:Data/28221880-678a-46f1-b0c2-919f62de5b14", + "ld_id": "chromatopy:Data/e42171d5-280e-41fa-a27d-db3406f3e361", "ld_type": [ "chromatopy:Data" ], @@ -28299,7 +28299,7 @@ "exponent": 1, "multiplier": null, "scale": 1.0, - "ld_id": "chromatopy:BaseUnit/3b13d4af-ea69-4755-b635-651eeb8ba1e2", + "ld_id": "chromatopy:BaseUnit/0118c05d-1ffd-4771-9c7f-0c50d930000e", "ld_type": [ "chromatopy:BaseUnit" ], @@ -28308,7 +28308,7 @@ } } ], - "ld_id": "chromatopy:UnitDefinition/c11ca252-c8a2-48ce-8b8c-adef59b964c9", + "ld_id": "chromatopy:UnitDefinition/6b4c7713-3f5e-41b2-867f-2240f06c68a0", "ld_type": [ "OBO:UO_0000000" ], @@ -28335,7 +28335,7 @@ "separation_factor": 0.0, "peak_start": 0.458, "peak_end": 0.767, - "ld_id": "chromatopy:Peak/5d24322a-23e6-48a7-92a1-d8200ae2727c", + "ld_id": "chromatopy:Peak/0f544bd7-68d6-4473-ac9d-dd9be044fd04", "ld_type": [ "chromatopy:Peak" ], @@ -28357,7 +28357,7 @@ "separation_factor": 0.0, "peak_start": 2.667, "peak_end": 2.867, - "ld_id": "chromatopy:Peak/56fe1895-336c-4556-a0ed-7ba1435d73aa", + "ld_id": "chromatopy:Peak/86ae052d-8668-4bf7-8e88-3465b67d0386", "ld_type": [ "chromatopy:Peak" ], @@ -28379,7 +28379,7 @@ "separation_factor": 1.231, "peak_start": 2.917, "peak_end": 3.467, - "ld_id": "chromatopy:Peak/77c7b1e1-10db-406a-80a8-8fe36fc2c6c3", + "ld_id": "chromatopy:Peak/4c4926ee-bd6e-450b-8d07-d6b1c1a0517d", "ld_type": [ "chromatopy:Peak" ], @@ -28401,7 +28401,7 @@ "separation_factor": 1.324, "peak_start": 3.467, "peak_end": 4.95, - "ld_id": "chromatopy:Peak/aff37956-3031-4b6d-8f8a-bd0a36603561", + "ld_id": "chromatopy:Peak/914cbd8e-a837-4ec8-93c8-9efec2e908a1", "ld_type": [ "chromatopy:Peak" ], @@ -28423,7 +28423,7 @@ "separation_factor": 1.347, "peak_start": 4.95, "peak_end": 6.808, - "ld_id": "chromatopy:Peak/ab87eb9a-f3ca-42c0-9283-1c1f19cfcc49", + "ld_id": "chromatopy:Peak/47265d93-55ea-4a24-88a3-b02630b977bc", "ld_type": [ "chromatopy:Peak" ], @@ -28445,7 +28445,7 @@ "separation_factor": 1.405, "peak_start": 6.808, "peak_end": 7.642, - "ld_id": "chromatopy:Peak/ad7be24b-83f9-4b01-bab2-e075aa3014db", + "ld_id": "chromatopy:Peak/e3d78887-6fd2-415d-93f2-5cb24ddf9ded", "ld_type": [ "chromatopy:Peak" ], @@ -28467,7 +28467,7 @@ "separation_factor": 1.132, "peak_start": 7.642, "peak_end": 9.033, - "ld_id": "chromatopy:Peak/5815b54d-4209-4fc0-bbaa-b82abc634226", + "ld_id": "chromatopy:Peak/c925d6ac-60ef-45b3-b43e-564ff80a982e", "ld_type": [ "chromatopy:Peak" ], @@ -28489,7 +28489,7 @@ "separation_factor": 1.179, "peak_start": 9.033, "peak_end": 10.608, - "ld_id": "chromatopy:Peak/51370b10-bca5-410d-a9d0-c1793b7e9002", + "ld_id": "chromatopy:Peak/59f297c4-3998-43f7-aac3-eeddfd5fca5e", "ld_type": [ "chromatopy:Peak" ], @@ -28511,7 +28511,7 @@ "separation_factor": 1.179, "peak_start": 10.608, "peak_end": 11.325, - "ld_id": "chromatopy:Peak/4f375bec-be08-4ae3-a626-ad261b4dc613", + "ld_id": "chromatopy:Peak/5310ef90-7060-4a6d-9e8e-370cc939abc5", "ld_type": [ "chromatopy:Peak" ], @@ -28533,7 +28533,7 @@ "separation_factor": 1.072, "peak_start": 11.325, "peak_end": 12.55, - "ld_id": "chromatopy:Peak/3a866f9e-84a8-459c-b93b-82e990efb133", + "ld_id": "chromatopy:Peak/c597fac8-11e1-43e5-8ee4-c9c9d775b872", "ld_type": [ "chromatopy:Peak" ], @@ -28555,7 +28555,7 @@ "separation_factor": 1.109, "peak_start": 12.55, "peak_end": 13.142, - "ld_id": "chromatopy:Peak/ca88f072-935d-47fb-a116-c6e1f493ea59", + "ld_id": "chromatopy:Peak/667b2a6b-8645-441f-8dfe-421eee4b4732", "ld_type": [ "chromatopy:Peak" ], @@ -28577,7 +28577,7 @@ "separation_factor": 1.021, "peak_start": 13.142, "peak_end": 14.367, - "ld_id": "chromatopy:Peak/444c7f26-35da-4715-bc49-6019a05eed95", + "ld_id": "chromatopy:Peak/dff461e0-1c33-47e9-8897-18bb06404e19", "ld_type": [ "chromatopy:Peak" ], @@ -32194,7 +32194,7 @@ ], "processed_signal": [], "wavelength": 215.0, - "ld_id": "chromatopy:Chromatogram/faa1c841-9ff2-4dcc-b31e-01c602afa26b", + "ld_id": "chromatopy:Chromatogram/8e4eb2bd-7d99-4033-b29e-d6f24f02c92e", "ld_type": [ "chromatopy:Chromatogram" ], @@ -32216,7 +32216,7 @@ "exponent": 1, "multiplier": null, "scale": -6.0, - "ld_id": "chromatopy:BaseUnit/a443f75a-3474-4861-b486-b7b6879f43bd", + "ld_id": "chromatopy:BaseUnit/0e8b73ef-30a4-4d88-953e-fbe0a1cba7b4", "ld_type": [ "chromatopy:BaseUnit" ], @@ -32233,7 +32233,7 @@ "chromatopy": "https://github.com/FAIRChemistry/chromatopy" } }, - "ld_id": "chromatopy:Measurement/fa0c404f-cc3b-4763-b760-438d6ff5b49c", + "ld_id": "chromatopy:Measurement/ec909a89-85db-4f89-9f31-d86ec10eff73", "ld_type": [ "chromatopy:Measurement" ], @@ -32254,7 +32254,7 @@ "exponent": 1, "multiplier": 60.0, "scale": 1.0, - "ld_id": "chromatopy:BaseUnit/70a4517b-131a-450d-b527-1e8af2139815", + "ld_id": "chromatopy:BaseUnit/b33993a5-fcf1-4d7b-830e-ac12bb2fca19", "ld_type": [ "chromatopy:BaseUnit" ], @@ -32272,7 +32272,7 @@ } }, "data_type": "timecourse", - "ld_id": "chromatopy:Data/8beb7875-5028-447f-9252-3ad02f094ba9", + "ld_id": "chromatopy:Data/41beee98-5bb2-402c-8400-5d44ae16fe29", "ld_type": [ "chromatopy:Data" ], @@ -32290,7 +32290,7 @@ "exponent": 1, "multiplier": null, "scale": 1.0, - "ld_id": "chromatopy:BaseUnit/3b13d4af-ea69-4755-b635-651eeb8ba1e2", + "ld_id": "chromatopy:BaseUnit/0118c05d-1ffd-4771-9c7f-0c50d930000e", "ld_type": [ "chromatopy:BaseUnit" ], @@ -32299,7 +32299,7 @@ } } ], - "ld_id": "chromatopy:UnitDefinition/c11ca252-c8a2-48ce-8b8c-adef59b964c9", + "ld_id": "chromatopy:UnitDefinition/6b4c7713-3f5e-41b2-867f-2240f06c68a0", "ld_type": [ "OBO:UO_0000000" ], @@ -32326,7 +32326,7 @@ "separation_factor": 0.0, "peak_start": 0.025, "peak_end": 0.508, - "ld_id": "chromatopy:Peak/9668cac7-bf57-4b04-9868-803e0bfb75f9", + "ld_id": "chromatopy:Peak/ef8f7e73-08f5-4ff0-a22e-9446bf7548e5", "ld_type": [ "chromatopy:Peak" ], @@ -32348,7 +32348,7 @@ "separation_factor": 0.0, "peak_start": 0.592, "peak_end": 1.058, - "ld_id": "chromatopy:Peak/1f43d931-2b35-4695-aa2b-7f1518112675", + "ld_id": "chromatopy:Peak/235ce74a-d22f-4fb5-a4cb-b34784b6fbab", "ld_type": [ "chromatopy:Peak" ], @@ -32370,7 +32370,7 @@ "separation_factor": 4.841, "peak_start": 2.892, "peak_end": 3.467, - "ld_id": "chromatopy:Peak/d533a9e1-8469-4ef1-ba3c-74af0e2173ee", + "ld_id": "chromatopy:Peak/da5258c8-10e6-4585-8e94-27e670328145", "ld_type": [ "chromatopy:Peak" ], @@ -32392,7 +32392,7 @@ "separation_factor": 1.284, "peak_start": 3.467, "peak_end": 4.917, - "ld_id": "chromatopy:Peak/8eccd6c5-ec74-470b-a595-949d930f2be2", + "ld_id": "chromatopy:Peak/bb6d0a43-dfe4-4a3b-8923-ba61223cb2f6", "ld_type": [ "chromatopy:Peak" ], @@ -32414,7 +32414,7 @@ "separation_factor": 1.32, "peak_start": 4.917, "peak_end": 6.742, - "ld_id": "chromatopy:Peak/c7ea17a4-9ffb-4ee5-ba18-03160b0b4e33", + "ld_id": "chromatopy:Peak/f7f1cc49-fe0a-4322-ad41-470c7d128d55", "ld_type": [ "chromatopy:Peak" ], @@ -32436,7 +32436,7 @@ "separation_factor": 1.372, "peak_start": 6.742, "peak_end": 7.558, - "ld_id": "chromatopy:Peak/cc35f9ee-0953-409d-95a9-b60ce0668723", + "ld_id": "chromatopy:Peak/7669f076-1302-42d0-b76b-c3ae3c64422a", "ld_type": [ "chromatopy:Peak" ], @@ -32458,7 +32458,7 @@ "separation_factor": 1.125, "peak_start": 7.558, "peak_end": 8.967, - "ld_id": "chromatopy:Peak/73ca14f3-5766-4d65-81e1-59053ef2ff34", + "ld_id": "chromatopy:Peak/20744ed1-703e-48cd-bccd-13e3c90ae17e", "ld_type": [ "chromatopy:Peak" ], @@ -32480,7 +32480,7 @@ "separation_factor": 1.174, "peak_start": 8.967, "peak_end": 10.508, - "ld_id": "chromatopy:Peak/eafb068d-b35a-48c2-a84d-0b2013b143b1", + "ld_id": "chromatopy:Peak/6c03571c-bf36-41d9-b797-aea3a42d1ca8", "ld_type": [ "chromatopy:Peak" ], @@ -32502,7 +32502,7 @@ "separation_factor": 1.155, "peak_start": 10.508, "peak_end": 11.208, - "ld_id": "chromatopy:Peak/8289dd6d-03b3-4813-a1bf-a9ed08bc9972", + "ld_id": "chromatopy:Peak/338f7e43-a131-427a-8a45-a49c5bc6f743", "ld_type": [ "chromatopy:Peak" ], @@ -32524,7 +32524,7 @@ "separation_factor": 1.093, "peak_start": 11.208, "peak_end": 12.542, - "ld_id": "chromatopy:Peak/438af93e-1c16-4cda-aa5f-f361ab9d1e53", + "ld_id": "chromatopy:Peak/90ab7651-8dcc-4a05-83be-3cc51ced8c06", "ld_type": [ "chromatopy:Peak" ], @@ -32546,7 +32546,7 @@ "separation_factor": 1.078, "peak_start": 12.542, "peak_end": 13.008, - "ld_id": "chromatopy:Peak/e89ca265-23bd-4289-9903-fd98bf6fa9ab", + "ld_id": "chromatopy:Peak/9916653c-4b79-4a17-b1ce-79d9bab7876d", "ld_type": [ "chromatopy:Peak" ], @@ -32568,7 +32568,7 @@ "separation_factor": 1.034, "peak_start": 13.008, "peak_end": 14.175, - "ld_id": "chromatopy:Peak/4096f486-618f-4677-b16f-f4a4f855cde3", + "ld_id": "chromatopy:Peak/34ad34bd-ff92-484c-8e89-c3f57ca5ffd9", "ld_type": [ "chromatopy:Peak" ], @@ -32590,7 +32590,7 @@ "separation_factor": 1.094, "peak_start": 14.175, "peak_end": 14.4, - "ld_id": "chromatopy:Peak/8974bff0-2887-45d0-ac53-bdd232f86c19", + "ld_id": "chromatopy:Peak/9a4b8765-dc66-4ea8-9cf7-ad214206881f", "ld_type": [ "chromatopy:Peak" ], @@ -36207,7 +36207,7 @@ ], "processed_signal": [], "wavelength": 215.0, - "ld_id": "chromatopy:Chromatogram/8756e9a9-cf83-4f79-befa-38c6f93d7b5d", + "ld_id": "chromatopy:Chromatogram/b505ce01-cff5-4858-be59-51706af58d81", "ld_type": [ "chromatopy:Chromatogram" ], @@ -36229,7 +36229,7 @@ "exponent": 1, "multiplier": null, "scale": -6.0, - "ld_id": "chromatopy:BaseUnit/a443f75a-3474-4861-b486-b7b6879f43bd", + "ld_id": "chromatopy:BaseUnit/0e8b73ef-30a4-4d88-953e-fbe0a1cba7b4", "ld_type": [ "chromatopy:BaseUnit" ], @@ -36246,7 +36246,7 @@ "chromatopy": "https://github.com/FAIRChemistry/chromatopy" } }, - "ld_id": "chromatopy:Measurement/eb5d769f-7e31-4a07-b32f-0974e43fc8ef", + "ld_id": "chromatopy:Measurement/431e0cd5-6270-4490-ac7e-72733c657a1c", "ld_type": [ "chromatopy:Measurement" ], diff --git a/docs/examples/read_data.ipynb b/docs/examples/read_data.ipynb index d230048..856f500 100644 --- a/docs/examples/read_data.ipynb +++ b/docs/examples/read_data.ipynb @@ -143,6 +143,31 @@ ")" ] }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "The `read_agilent` method also reads rdl formatted *.txt files." + ] + }, + { + "cell_type": "code", + "execution_count": null, + "metadata": {}, + "outputs": [], + "source": [ + "from chromatopy import ChromAnalyzer, minute\n", + "\n", + "data_dir = \"data/agilent_rdl\"\n", + "\n", + "analyzer = ChromAnalyzer.read_agilent(\n", + " path=data_dir,\n", + " ph=7.4,\n", + " temperature=25,\n", + " mode=\"timecourse\",\n", + ")" + ] + }, { "cell_type": "markdown", "metadata": {}, @@ -227,7 +252,7 @@ }, { "cell_type": "code", - "execution_count": 6, + "execution_count": 7, "metadata": {}, "outputs": [], "source": [ diff --git a/docs/examples/read_data.md b/docs/examples/read_data.md index cc85a0d..4c77803 100644 --- a/docs/examples/read_data.md +++ b/docs/examples/read_data.md @@ -87,6 +87,24 @@ analyzer = ChromAnalyzer.read_agilent( ✅ Loaded 4 chromatograms. ``` +The `read_agilent` method also reads rdl formatted *.txt files. + +```python +from chromatopy import ChromAnalyzer, minute + +data_dir = "data/agilent_rdl" + +analyzer = ChromAnalyzer.read_agilent( + path=data_dir, + ph=7.4, + temperature=25, + mode="timecourse", +) +``` +``` +✅ Loaded 1 chromatograms. +``` + ### Chromeleon Chromeleon files can be read in with the `read_chromeleon` function. Please note that this function relies on the existence of a `*.txt` file in the directory. If applicable use OpenChrom to preproces and convert your files from Thermo Fisher Scientific to the ASM format. diff --git a/docs/supported_formats.md b/docs/supported_formats.md index 00d0599..903edc1 100644 --- a/docs/supported_formats.md +++ b/docs/supported_formats.md @@ -129,6 +129,51 @@ As an alternative to the ASM format, `chromatopy` supports the import of chromat 2=, 2, 6.302, 899, 903, 909," M ",1063632, 7963360, 57.91, 36.672 ``` + === "Agilent rdl formatted *.TXT" + + ``` + ┌──────────────────────────────────────────────────────────────────────────────┐ + │Cross Sequence Summary Report │ + └──────────────────────────────────────────────────────────────────────────────┘ + ┌────────────────┬──────────────────────────────────────────────────────────┐ + │Sample Name │M2_MJ_ │ + │ │100_min │ + └────────────────┴──────────────────────────────────────────────────────────┘ + ┌───────┬────────────────────────────────────────────────────────────────────┐ + │Signal:│DAD1A,Sig=254,4 Ref=360,100 │ + └───────┴────────────────────────────────────────────────────────────────────┘ + ┌───────┬───┬────────┬────────┬───────┬────────┬─────────────────────────────┐ + │ RT │Typ│ Width │ Area │ Height│ Area% │Name │ + │ [min] │e │ [min] │ │ │ │ │ + ├───────┼───┼────────┼────────┼───────┼────────┼─────────────────────────────┤ + │ 0.698 │BV │ 0.4062 │ 53. │ 7.2642│ 0.3671 │ │ + │ │ │ │ 0992 │ │ │ │ + ├───────┼───┼────────┼────────┼───────┼────────┼─────────────────────────────┤ + │ 1.169 │VV │ 0.8468 │ 6094. │ 783.│ 42. │AMP@1,169min │ + │ │ │ │ 3336 │ 0775│ 1289 │ │ + ├───────┼───┼────────┼────────┼───────┼────────┼─────────────────────────────┤ + │ 2.756 │VB │ 0.4315 │ 14. │ 1.9341│ 0.0982 │ │ + │ │ │ │ 2114 │ │ │ │ + ├───────┼───┼────────┼────────┼───────┼────────┼─────────────────────────────┤ + │ 3.331 │BV │ 0.7823 │ 7620. │ 925.│ 52. │ADP@3,327min │ + │ │ │ │ 7030 │ 5433│ 6804 │ │ + ├───────┼───┼────────┼────────┼───────┼────────┼─────────────────────────────┤ + │ 3.974 │VB │ 1.5648 │ 381. │ 55.│ 2.6397 │ │ + │ │ │ │ 8593 │ 0016│ │ │ + ├───────┼───┼────────┼────────┼───────┼────────┼─────────────────────────────┤ + │ 5.770 │BB │ 1.0452 │ 301. │ 22.│ 2.0856 │ATP@5,720min │ + │ │ │ │ 7014 │ 1066│ │ │ + ├───────┼───┼────────┼────────┼───────┼────────┼─────────────────────────────┤ + │ │ │ Sum │ 14465. │ │ │ │ + │ │ │ │ 9079 │ │ │ │ + └───────┴───┴────────┴────────┴───────┴────────┴─────────────────────────────┘ + ┌───────────────────────────┬────────────────────────────────┬─────────────────┐ + │D:\CDSProjects\JNS\Report │ Printed: 2024-10-20 │ Page 1 of 1 │ + │Templates\Export_for_ │ 16:25:44+02:00 │ │ + │python.rdl [Rev. 2.0] │ │ │ + ════════════════════════════════════════════════════════════════════════════════ + ``` + === "Shimadzu *.TXT" ```