diff --git a/src/allotropy/allotrope/converter.py b/src/allotropy/allotrope/converter.py index 0a6814a167..bd5dad12bd 100644 --- a/src/allotropy/allotrope/converter.py +++ b/src/allotropy/allotrope/converter.py @@ -112,6 +112,7 @@ "=": "_EQUALS_", "@": "_AT_", "'": "_QUOTE_", + "*": "_ASTERISK_", ",": "_COMMA_", "&": "_AMPERSAND_", # NOTE: this MUST be at the end, or it will break other key replacements. diff --git a/src/allotropy/allotrope/models/shared/definitions/custom.py b/src/allotropy/allotrope/models/shared/definitions/custom.py index 67fe0ac348..101dcf6fc7 100644 --- a/src/allotropy/allotrope/models/shared/definitions/custom.py +++ b/src/allotropy/allotrope/models/shared/definitions/custom.py @@ -54,6 +54,7 @@ PartsPerBillion, PartsPerMillion, Percent, + PerMolarPerCentimeter, PerMolarPerSecond, PerSecond, PH, @@ -610,6 +611,18 @@ class TNullableQuantityValuePartsPerMillion(PartsPerMillion, TNullableQuantityVa pass +@dataclass(frozen=True, kw_only=True) +class TQuantityValuePerMolarPerCentimeter(PerMolarPerCentimeter, TQuantityValue): + pass + + +@dataclass(frozen=True, kw_only=True) +class TNullableQuantityValuePerMolarPerCentimeter( + PerMolarPerCentimeter, TNullableQuantityValue +): + pass + + @dataclass(frozen=True, kw_only=True) class TQuantityValuePerMolarPerSecond(PerMolarPerSecond, TQuantityValue): pass diff --git a/src/allotropy/allotrope/models/shared/definitions/units.py b/src/allotropy/allotrope/models/shared/definitions/units.py index c0b15601ea..db71812fff 100644 --- a/src/allotropy/allotrope/models/shared/definitions/units.py +++ b/src/allotropy/allotrope/models/shared/definitions/units.py @@ -249,6 +249,11 @@ class PartsPerMillion(HasUnit): unit: str = "ppm" +@dataclass(frozen=True, kw_only=True) +class PerMolarPerCentimeter(HasUnit): + unit: str = "M-1cm-1" + + @dataclass(frozen=True, kw_only=True) class PerMolarPerSecond(HasUnit): unit: str = "M-1s-1" diff --git a/src/allotropy/allotrope/schema_mappers/adm/spectrophotometry/benchling/_2023/_12/spectrophotometry.py b/src/allotropy/allotrope/schema_mappers/adm/spectrophotometry/benchling/_2023/_12/spectrophotometry.py index 4f41ee72f1..25136f4bfd 100644 --- a/src/allotropy/allotrope/schema_mappers/adm/spectrophotometry/benchling/_2023/_12/spectrophotometry.py +++ b/src/allotropy/allotrope/schema_mappers/adm/spectrophotometry/benchling/_2023/_12/spectrophotometry.py @@ -29,9 +29,12 @@ UltravioletAbsorbanceSpectrumDetectionMeasurementDocumentItems, ) from allotropy.allotrope.models.shared.definitions.custom import ( + TQuantityValueKiloDalton, TQuantityValueMicroliter, TQuantityValueMilliAbsorbanceUnit, + TQuantityValueNanogramPerMicroliter, TQuantityValueNanometer, + TQuantityValuePerMolarPerCentimeter, TQuantityValueRelativeFluorescenceUnit, TQuantityValueUnitless, ) @@ -77,6 +80,7 @@ class ProcessedDataFeature: class ProcessedData: features: list[ProcessedDataFeature] identifier: str | None = None + custom_info: dict[str, Any] | None = None @dataclass @@ -102,6 +106,8 @@ class Measurement: original_sample_concentration_unit: str | None = None baseline_absorbance: float | None = None electronic_absorbance_reference_wavelength_setting: float | None = None + cursor_position: float | None = None + cursor_absorbance: float | None = None # Measurements absorbance: JsonFloat | None = None @@ -269,6 +275,14 @@ def _get_ultraviolet_absorbance_measurement_document( TQuantityValueMilliAbsorbanceUnit, measurement.baseline_absorbance, ), + "340 raw": quantity_or_none( + TQuantityValueMilliAbsorbanceUnit, + (measurement.custom_info or {}).get("340 raw"), + ), + "Cursor Abs.": quantity_or_none( + TQuantityValueMilliAbsorbanceUnit, + measurement.cursor_absorbance, + ), } return add_custom_information_document(doc, custom_info_doc) @@ -341,6 +355,9 @@ def _get_device_control_custom_document( "dilution factor": quantity_or_none( TQuantityValueUnitless, measurement.dilution_factor_setting ), + "Cursor Pos.": quantity_or_none( + TQuantityValueNanometer, measurement.cursor_position + ), } return (measurement.device_control_custom_info or {}) | custom_info @@ -363,6 +380,11 @@ def _get_sample_document(self, measurement: Measurement) -> SampleDocument: measurement.sample_custom_info["last read standards"] ) + sample_custom_info = measurement.sample_custom_info or {} + sample_custom_info["Mol. Wt. kda"] = quantity_or_none( + TQuantityValueKiloDalton, sample_custom_info.get("Mol. Wt. kda") + ) + return add_custom_information_document( SampleDocument( sample_identifier=measurement.sample_identifier, @@ -370,7 +392,7 @@ def _get_sample_document(self, measurement: Measurement) -> SampleDocument: location_identifier=measurement.location_identifier, well_plate_identifier=measurement.well_plate_identifier, ), - (measurement.sample_custom_info or {}) | custom_info_doc, + sample_custom_info | custom_info_doc, ) def _get_processed_data_aggregate_document( @@ -379,14 +401,38 @@ def _get_processed_data_aggregate_document( if not data: return None + # Build custom info for processed data with proper TQuantityValue wrappers + processed_data_custom_info = {} + if data.custom_info: + processed_data_custom_info = { + "E1%": quantity_or_none( + TQuantityValueUnitless, data.custom_info.get("E1%") + ), + "ext. coeff x10e3": quantity_or_none( + TQuantityValuePerMolarPerCentimeter, + data.custom_info.get("ext. coeff x10e3"), + ), + "ext.c.": quantity_or_none( + TQuantityValuePerMolarPerCentimeter, + data.custom_info.get("ext.c. (l/(mol*cm))"), + ), + "conc. factor": quantity_or_none( + TQuantityValueNanogramPerMicroliter, + data.custom_info.get("conc. factor (ng/ul)"), + ), + } + return ProcessedDataAggregateDocument( processed_data_document=[ - ProcessedDataDocumentItem( - # TODO(nstender): figure out how to limit possible classes from get_quantity_class for typing. - mass_concentration=quantity_or_none( - get_quantity_class(feature.unit), feature.result # type: ignore[arg-type] + add_custom_information_document( + ProcessedDataDocumentItem( + # TODO(nstender): figure out how to limit possible classes from get_quantity_class for typing. + mass_concentration=quantity_or_none( + get_quantity_class(feature.unit), feature.result # type: ignore[arg-type] + ), + processed_data_identifier=data.identifier, ), - processed_data_identifier=data.identifier, + processed_data_custom_info, ) for feature in data.features ] diff --git a/src/allotropy/allotrope/schemas/shared/definitions/custom.json b/src/allotropy/allotrope/schemas/shared/definitions/custom.json index cb78b2c302..1efe26dc61 100644 --- a/src/allotropy/allotrope/schemas/shared/definitions/custom.json +++ b/src/allotropy/allotrope/schemas/shared/definitions/custom.json @@ -959,6 +959,26 @@ } ] }, + "tQuantityValuePerMolarPerCentimeter": { + "allOf": [ + { + "$ref": "#/$defs/tQuantityValue" + }, + { + "$ref": "#/$defs/PerMolarPerCentimeter" + } + ] + }, + "tNullableQuantityValuePerMolarPerCentimeter": { + "allOf": [ + { + "$ref": "#/$defs/tNullableQuantityValue" + }, + { + "$ref": "#/$defs/PerMolarPerCentimeter" + } + ] + }, "tQuantityValuePerMolarPerSecond": { "allOf": [ { diff --git a/src/allotropy/allotrope/schemas/shared/definitions/units.json b/src/allotropy/allotrope/schemas/shared/definitions/units.json index 9cd7d76613..52095c83d2 100644 --- a/src/allotropy/allotrope/schemas/shared/definitions/units.json +++ b/src/allotropy/allotrope/schemas/shared/definitions/units.json @@ -575,6 +575,18 @@ "unit" ] }, + "PerMolarPerCentimeter": { + "properties": { + "unit": { + "type": "string", + "const": "M-1cm-1", + "$asm.unit-iri": "http://purl.allotrope.org/ontology/qudt-ext/unit#PerMolarPerCentimeter" + } + }, + "required": [ + "unit" + ] + }, "PerMolarPerSecond": { "properties": { "unit": { diff --git a/src/allotropy/parsers/thermo_fisher_nanodrop_8000/nanodrop_8000_structure.py b/src/allotropy/parsers/thermo_fisher_nanodrop_8000/nanodrop_8000_structure.py index e141626f14..113f44235b 100644 --- a/src/allotropy/parsers/thermo_fisher_nanodrop_8000/nanodrop_8000_structure.py +++ b/src/allotropy/parsers/thermo_fisher_nanodrop_8000/nanodrop_8000_structure.py @@ -166,6 +166,14 @@ def create(data: SeriesData) -> SpectroscopyRow: ) unit = data.get(str, "units") + # Read fields for Data Processing Document custom info + processed_data_custom_info = { + "E1%": data.get(float, "e 1%"), + "ext. coeff x10e3": data.get(float, "ext. coeff x10e3"), + "ext.c. (l/(mol*cm))": data.get(float, "ext.c. (l/(mol*cm))"), + "conc. factor (ng/ul)": data.get(float, "conc. factor (ng/ul)"), + } + measurements: list[Measurement] = [] for wavelength, absorbance in absorbances.items(): if absorbance is None: @@ -190,11 +198,30 @@ def create(data: SeriesData) -> SpectroscopyRow: unit=unit, ) ], + custom_info=processed_data_custom_info or None, ) if mass_concentration_capture_wavelength == wavelength and mass_concentration and unit else None, + cursor_position=data.get(float, "cursor pos."), + cursor_absorbance=data.get(float, "cursor abs."), + sample_custom_info={ + "Mol. Wt. kda": data.get(float, "mol. wt. kda"), + }, + custom_info=data.get_unread( + skip={ + "date", + "time", + "user id", + "formula value 1", + "formula name 1", + "formula 1", + "260/230", + "260/280", + "m.w. (g/mol)", + } + ), ) ) diff --git a/tests/parsers/thermo_fisher_nanodrop_8000/testdata/Thermo_NanoDrop_8000_example01.json b/tests/parsers/thermo_fisher_nanodrop_8000/testdata/Thermo_NanoDrop_8000_example01.json index b758bc1e6c..b299e3d7ed 100644 --- a/tests/parsers/thermo_fisher_nanodrop_8000/testdata/Thermo_NanoDrop_8000_example01.json +++ b/tests/parsers/thermo_fisher_nanodrop_8000/testdata/Thermo_NanoDrop_8000_example01.json @@ -15,6 +15,12 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] @@ -22,7 +28,13 @@ "sample document": { "sample identifier": "baz", "location identifier": "A1", - "well plate identifier": "foobar" + "well plate identifier": "foobar", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 3.177, @@ -34,9 +46,25 @@ "mass concentration": { "value": 1.961, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 16.2, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 3.177, + "unit": "mAU" + } } } ] @@ -56,6 +84,12 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] @@ -63,7 +97,13 @@ "sample document": { "sample identifier": "baz", "location identifier": "B1", - "well plate identifier": "foobar" + "well plate identifier": "foobar", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 3.409, @@ -75,9 +115,25 @@ "mass concentration": { "value": 2.104, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 16.2, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 3.409, + "unit": "mAU" + } } } ] @@ -97,6 +153,12 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] @@ -104,7 +166,13 @@ "sample document": { "sample identifier": "baz", "location identifier": "C1", - "well plate identifier": "foobar" + "well plate identifier": "foobar", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 3.43, @@ -116,9 +184,25 @@ "mass concentration": { "value": 2.117, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 16.2, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 3.43, + "unit": "mAU" + } } } ] @@ -138,6 +222,12 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] @@ -145,7 +235,13 @@ "sample document": { "sample identifier": "baz", "location identifier": "D1", - "well plate identifier": "foobar" + "well plate identifier": "foobar", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 3.144, @@ -157,9 +253,25 @@ "mass concentration": { "value": 1.941, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 16.2, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 3.144, + "unit": "mAU" + } } } ] @@ -179,6 +291,12 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] @@ -186,7 +304,13 @@ "sample document": { "sample identifier": "baz", "location identifier": "E1", - "well plate identifier": "foobar" + "well plate identifier": "foobar", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 3.397, @@ -198,9 +322,25 @@ "mass concentration": { "value": 2.097, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 16.2, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 3.397, + "unit": "mAU" + } } } ] @@ -220,6 +360,12 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] @@ -227,7 +373,13 @@ "sample document": { "sample identifier": "baz", "location identifier": "F1", - "well plate identifier": "foobar" + "well plate identifier": "foobar", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 3.239, @@ -239,9 +391,25 @@ "mass concentration": { "value": 1.999, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 16.2, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 3.239, + "unit": "mAU" + } } } ] @@ -261,6 +429,12 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] @@ -268,7 +442,13 @@ "sample document": { "sample identifier": "baz", "location identifier": "G1", - "well plate identifier": "foobar" + "well plate identifier": "foobar", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 3.286, @@ -280,9 +460,25 @@ "mass concentration": { "value": 2.028, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 16.2, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 3.286, + "unit": "mAU" + } } } ] @@ -298,7 +494,7 @@ "file name": "Thermo_NanoDrop_8000_example01.txt", "UNC path": "tests/parsers/thermo_fisher_nanodrop_8000/testdata/Thermo_NanoDrop_8000_example01.txt", "ASM converter name": "allotropy_thermo_fisher_scientific_nanodrop_8000", - "ASM converter version": "0.1.62" + "ASM converter version": "0.1.106" }, "calculated data aggregate document": { "calculated data document": [ diff --git a/tests/parsers/thermo_fisher_nanodrop_8000/testdata/Thermo_NanoDrop_8000_example02.json b/tests/parsers/thermo_fisher_nanodrop_8000/testdata/Thermo_NanoDrop_8000_example02.json index 977028a641..7c20473bc6 100644 --- a/tests/parsers/thermo_fisher_nanodrop_8000/testdata/Thermo_NanoDrop_8000_example02.json +++ b/tests/parsers/thermo_fisher_nanodrop_8000/testdata/Thermo_NanoDrop_8000_example02.json @@ -15,13 +15,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "8", - "location identifier": "A1" + "location identifier": "A1", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 4.142, @@ -33,9 +45,25 @@ "mass concentration": { "value": 4.142, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 4.142, + "unit": "mAU" + } } } ] @@ -55,13 +83,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "8", - "location identifier": "B1" + "location identifier": "B1", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 4.153, @@ -73,9 +113,25 @@ "mass concentration": { "value": 4.153, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 4.153, + "unit": "mAU" + } } } ] @@ -95,13 +151,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "8", - "location identifier": "C1" + "location identifier": "C1", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 4.138, @@ -113,9 +181,25 @@ "mass concentration": { "value": 4.138, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 4.138, + "unit": "mAU" + } } } ] @@ -135,13 +219,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "11", - "location identifier": "D1" + "location identifier": "D1", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 4.158, @@ -153,9 +249,25 @@ "mass concentration": { "value": 4.158, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 4.158, + "unit": "mAU" + } } } ] @@ -175,13 +287,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "11", - "location identifier": "E1" + "location identifier": "E1", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 4.18, @@ -193,9 +317,25 @@ "mass concentration": { "value": 4.18, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 4.18, + "unit": "mAU" + } } } ] @@ -215,13 +355,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "11", - "location identifier": "F1" + "location identifier": "F1", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 4.185, @@ -233,9 +385,25 @@ "mass concentration": { "value": 4.185, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 4.185, + "unit": "mAU" + } } } ] @@ -255,13 +423,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "13", - "location identifier": "A2" + "location identifier": "A2", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 4.56, @@ -273,9 +453,25 @@ "mass concentration": { "value": 4.56, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 4.56, + "unit": "mAU" + } } } ] @@ -295,13 +491,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "13", - "location identifier": "B2" + "location identifier": "B2", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 4.544, @@ -313,9 +521,25 @@ "mass concentration": { "value": 4.544, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 4.544, + "unit": "mAU" + } } } ] @@ -335,13 +559,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "13", - "location identifier": "C2" + "location identifier": "C2", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 4.548, @@ -353,9 +589,25 @@ "mass concentration": { "value": 4.548, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 4.548, + "unit": "mAU" + } } } ] @@ -375,13 +627,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "6", - "location identifier": "A3" + "location identifier": "A3", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 41.724, @@ -393,9 +657,25 @@ "mass concentration": { "value": 41.72, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 41.724, + "unit": "mAU" + } } } ] @@ -415,13 +695,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "6", - "location identifier": "B3" + "location identifier": "B3", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 50.116, @@ -433,9 +725,25 @@ "mass concentration": { "value": 50.12, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 50.116, + "unit": "mAU" + } } } ] @@ -455,13 +763,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "6", - "location identifier": "C3" + "location identifier": "C3", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 44.989, @@ -473,9 +793,25 @@ "mass concentration": { "value": 44.99, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 44.989, + "unit": "mAU" + } } } ] @@ -495,13 +831,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "7", - "location identifier": "D3" + "location identifier": "D3", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 62.522, @@ -513,9 +861,25 @@ "mass concentration": { "value": 62.52, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 62.522, + "unit": "mAU" + } } } ] @@ -535,13 +899,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "7", - "location identifier": "E3" + "location identifier": "E3", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": -5.338, @@ -553,9 +929,25 @@ "mass concentration": { "value": -5.338, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": -5.338, + "unit": "mAU" + } } } ] @@ -575,13 +967,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "7", - "location identifier": "F3" + "location identifier": "F3", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": -8.199, @@ -593,9 +997,25 @@ "mass concentration": { "value": -8.199, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": -8.199, + "unit": "mAU" + } } } ] @@ -615,13 +1035,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "6", - "location identifier": "A3" + "location identifier": "A3", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 4.919, @@ -633,9 +1065,25 @@ "mass concentration": { "value": 4.919, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 4.919, + "unit": "mAU" + } } } ] @@ -655,13 +1103,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "6", - "location identifier": "B3" + "location identifier": "B3", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 4.871, @@ -673,9 +1133,25 @@ "mass concentration": { "value": 4.871, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 4.871, + "unit": "mAU" + } } } ] @@ -695,13 +1171,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "6", - "location identifier": "C3" + "location identifier": "C3", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 4.829, @@ -713,9 +1201,25 @@ "mass concentration": { "value": 4.829, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 4.829, + "unit": "mAU" + } } } ] @@ -735,13 +1239,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "7", - "location identifier": "D3" + "location identifier": "D3", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 5.333, @@ -753,9 +1269,25 @@ "mass concentration": { "value": 5.333, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 5.333, + "unit": "mAU" + } } } ] @@ -775,13 +1307,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "7", - "location identifier": "E3" + "location identifier": "E3", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 5.3, @@ -793,9 +1337,25 @@ "mass concentration": { "value": 5.3, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 5.3, + "unit": "mAU" + } } } ] @@ -815,13 +1375,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "7", - "location identifier": "F3" + "location identifier": "F3", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 5.326, @@ -833,9 +1405,25 @@ "mass concentration": { "value": 5.326, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 5.326, + "unit": "mAU" + } } } ] @@ -855,13 +1443,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "9", - "location identifier": "A4" + "location identifier": "A4", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 6.969, @@ -873,9 +1473,25 @@ "mass concentration": { "value": 6.969, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 6.969, + "unit": "mAU" + } } } ] @@ -895,13 +1511,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "9", - "location identifier": "B4" + "location identifier": "B4", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 6.935, @@ -913,9 +1541,25 @@ "mass concentration": { "value": 6.935, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 6.935, + "unit": "mAU" + } } } ] @@ -935,13 +1579,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "9", - "location identifier": "C4" + "location identifier": "C4", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 6.972, @@ -953,9 +1609,25 @@ "mass concentration": { "value": 6.972, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 6.972, + "unit": "mAU" + } } } ] @@ -975,13 +1647,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "10", - "location identifier": "D4" + "location identifier": "D4", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 4.813, @@ -993,9 +1677,25 @@ "mass concentration": { "value": 4.813, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 4.813, + "unit": "mAU" + } } } ] @@ -1015,13 +1715,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "10", - "location identifier": "E4" + "location identifier": "E4", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 4.795, @@ -1033,9 +1745,25 @@ "mass concentration": { "value": 4.795, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 4.795, + "unit": "mAU" + } } } ] @@ -1055,13 +1783,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "10", - "location identifier": "F4" + "location identifier": "F4", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 4.812, @@ -1073,9 +1813,25 @@ "mass concentration": { "value": 4.812, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 4.812, + "unit": "mAU" + } } } ] @@ -1095,13 +1851,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "12", - "location identifier": "A5" + "location identifier": "A5", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 4.199, @@ -1113,9 +1881,25 @@ "mass concentration": { "value": 4.199, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 4.199, + "unit": "mAU" + } } } ] @@ -1135,13 +1919,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "12", - "location identifier": "B5" + "location identifier": "B5", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 4.175, @@ -1153,9 +1949,25 @@ "mass concentration": { "value": 4.175, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 4.175, + "unit": "mAU" + } } } ] @@ -1175,13 +1987,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "12", - "location identifier": "C5" + "location identifier": "C5", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 4.163, @@ -1193,9 +2017,25 @@ "mass concentration": { "value": 4.163, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 4.163, + "unit": "mAU" + } } } ] @@ -1215,13 +2055,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "14", - "location identifier": "D5" + "location identifier": "D5", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 4.514, @@ -1233,9 +2085,25 @@ "mass concentration": { "value": 4.514, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 4.514, + "unit": "mAU" + } } } ] @@ -1255,13 +2123,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "14", - "location identifier": "E5" + "location identifier": "E5", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 4.528, @@ -1273,9 +2153,25 @@ "mass concentration": { "value": 4.528, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 4.528, + "unit": "mAU" + } } } ] @@ -1295,13 +2191,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "14", - "location identifier": "F5" + "location identifier": "F5", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 4.558, @@ -1313,9 +2221,25 @@ "mass concentration": { "value": 4.558, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 4.558, + "unit": "mAU" + } } } ] @@ -1335,13 +2259,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "N/A", - "location identifier": "A6" + "location identifier": "A6", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 4.572, @@ -1353,9 +2289,25 @@ "mass concentration": { "value": 4.572, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 4.572, + "unit": "mAU" + } } } ] @@ -1375,13 +2327,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "N/A", - "location identifier": "B6" + "location identifier": "B6", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 4.54, @@ -1393,9 +2357,25 @@ "mass concentration": { "value": 4.54, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 4.54, + "unit": "mAU" + } } } ] @@ -1415,13 +2395,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "N/A", - "location identifier": "C6" + "location identifier": "C6", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 4.546, @@ -1433,9 +2425,25 @@ "mass concentration": { "value": 4.546, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 4.546, + "unit": "mAU" + } } } ] @@ -1455,13 +2463,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "N/A", - "location identifier": "D6" + "location identifier": "D6", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 4.532, @@ -1473,9 +2493,25 @@ "mass concentration": { "value": 4.532, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 4.532, + "unit": "mAU" + } } } ] @@ -1495,13 +2531,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "N/A", - "location identifier": "E6" + "location identifier": "E6", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 4.542, @@ -1513,9 +2561,25 @@ "mass concentration": { "value": 4.542, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 4.542, + "unit": "mAU" + } } } ] @@ -1535,13 +2599,25 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 280.0, + "unit": "nm" + } } } ] }, "sample document": { "sample identifier": "N/A", - "location identifier": "F6" + "location identifier": "F6", + "custom information document": { + "Mol. Wt. kda": { + "value": 1.0, + "unit": "kDa" + } + } }, "absorbance": { "value": 4.537, @@ -1553,9 +2629,25 @@ "mass concentration": { "value": 4.537, "unit": "mg/mL" + }, + "custom information document": { + "E1%": { + "value": 10.0, + "unit": "(unitless)" + }, + "ext. coeff x10e3": { + "value": 1.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 4.537, + "unit": "mAU" + } } } ] @@ -1571,7 +2663,7 @@ "file name": "Thermo_NanoDrop_8000_example02.txt", "UNC path": "tests/parsers/thermo_fisher_nanodrop_8000/testdata/Thermo_NanoDrop_8000_example02.txt", "ASM converter name": "allotropy_thermo_fisher_scientific_nanodrop_8000", - "ASM converter version": "0.1.62" + "ASM converter version": "0.1.106" }, "calculated data aggregate document": { "calculated data document": [ diff --git a/tests/parsers/thermo_fisher_nanodrop_8000/testdata/Thermo_NanoDrop_8000_example03.json b/tests/parsers/thermo_fisher_nanodrop_8000/testdata/Thermo_NanoDrop_8000_example03.json index b3c5fd5807..c7d28ff4db 100644 --- a/tests/parsers/thermo_fisher_nanodrop_8000/testdata/Thermo_NanoDrop_8000_example03.json +++ b/tests/parsers/thermo_fisher_nanodrop_8000/testdata/Thermo_NanoDrop_8000_example03.json @@ -15,6 +15,12 @@ "detector wavelength setting": { "value": 260, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 260.0, + "unit": "nm" + } } } ] @@ -33,9 +39,25 @@ "mass concentration": { "value": 9.267, "unit": "ng/µL" + }, + "custom information document": { + "conc. factor": { + "value": 50.0, + "unit": "ng/µL" + } } } ] + }, + "custom information document": { + "340 raw": { + "value": 0.014, + "unit": "mAU" + }, + "Cursor Abs.": { + "value": 0.185, + "unit": "mAU" + } } }, { @@ -47,6 +69,12 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 260.0, + "unit": "nm" + } } } ] @@ -58,6 +86,12 @@ "absorbance": { "value": 0.082, "unit": "mAU" + }, + "custom information document": { + "Cursor Abs.": { + "value": 0.185, + "unit": "mAU" + } } } ], @@ -78,6 +112,12 @@ "detector wavelength setting": { "value": 260, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 260.0, + "unit": "nm" + } } } ] @@ -96,9 +136,25 @@ "mass concentration": { "value": 7.726, "unit": "ng/µL" + }, + "custom information document": { + "conc. factor": { + "value": 50.0, + "unit": "ng/µL" + } } } ] + }, + "custom information document": { + "340 raw": { + "value": 0.0, + "unit": "mAU" + }, + "Cursor Abs.": { + "value": 0.155, + "unit": "mAU" + } } }, { @@ -110,6 +166,12 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 260.0, + "unit": "nm" + } } } ] @@ -121,6 +183,12 @@ "absorbance": { "value": 0.075, "unit": "mAU" + }, + "custom information document": { + "Cursor Abs.": { + "value": 0.155, + "unit": "mAU" + } } } ], @@ -141,6 +209,12 @@ "detector wavelength setting": { "value": 260, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 260.0, + "unit": "nm" + } } } ] @@ -159,9 +233,25 @@ "mass concentration": { "value": 5.024, "unit": "ng/µL" + }, + "custom information document": { + "conc. factor": { + "value": 50.0, + "unit": "ng/µL" + } } } ] + }, + "custom information document": { + "340 raw": { + "value": -0.002, + "unit": "mAU" + }, + "Cursor Abs.": { + "value": 0.1, + "unit": "mAU" + } } }, { @@ -173,6 +263,12 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 260.0, + "unit": "nm" + } } } ] @@ -184,6 +280,12 @@ "absorbance": { "value": 0.051, "unit": "mAU" + }, + "custom information document": { + "Cursor Abs.": { + "value": 0.1, + "unit": "mAU" + } } } ], @@ -204,6 +306,12 @@ "detector wavelength setting": { "value": 260, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 260.0, + "unit": "nm" + } } } ] @@ -222,9 +330,25 @@ "mass concentration": { "value": 10.33, "unit": "ng/µL" + }, + "custom information document": { + "conc. factor": { + "value": 50.0, + "unit": "ng/µL" + } } } ] + }, + "custom information document": { + "340 raw": { + "value": 0.047, + "unit": "mAU" + }, + "Cursor Abs.": { + "value": 0.207, + "unit": "mAU" + } } }, { @@ -236,6 +360,12 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 260.0, + "unit": "nm" + } } } ] @@ -247,6 +377,12 @@ "absorbance": { "value": 0.11, "unit": "mAU" + }, + "custom information document": { + "Cursor Abs.": { + "value": 0.207, + "unit": "mAU" + } } } ], @@ -267,6 +403,12 @@ "detector wavelength setting": { "value": 260, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 260.0, + "unit": "nm" + } } } ] @@ -285,9 +427,25 @@ "mass concentration": { "value": 8.643, "unit": "ng/µL" + }, + "custom information document": { + "conc. factor": { + "value": 50.0, + "unit": "ng/µL" + } } } ] + }, + "custom information document": { + "340 raw": { + "value": 0.034, + "unit": "mAU" + }, + "Cursor Abs.": { + "value": 0.173, + "unit": "mAU" + } } }, { @@ -299,6 +457,12 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 260.0, + "unit": "nm" + } } } ] @@ -310,6 +474,12 @@ "absorbance": { "value": 0.096, "unit": "mAU" + }, + "custom information document": { + "Cursor Abs.": { + "value": 0.173, + "unit": "mAU" + } } } ], @@ -330,6 +500,12 @@ "detector wavelength setting": { "value": 260, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 260.0, + "unit": "nm" + } } } ] @@ -348,9 +524,25 @@ "mass concentration": { "value": 6.882, "unit": "ng/µL" + }, + "custom information document": { + "conc. factor": { + "value": 50.0, + "unit": "ng/µL" + } } } ] + }, + "custom information document": { + "340 raw": { + "value": 0.02, + "unit": "mAU" + }, + "Cursor Abs.": { + "value": 0.138, + "unit": "mAU" + } } }, { @@ -362,6 +554,12 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 260.0, + "unit": "nm" + } } } ] @@ -373,6 +571,12 @@ "absorbance": { "value": 0.085, "unit": "mAU" + }, + "custom information document": { + "Cursor Abs.": { + "value": 0.138, + "unit": "mAU" + } } } ], @@ -389,7 +593,7 @@ "file name": "Thermo_NanoDrop_8000_example03.txt", "UNC path": "tests/parsers/thermo_fisher_nanodrop_8000/testdata/Thermo_NanoDrop_8000_example03.txt", "ASM converter name": "allotropy_thermo_fisher_scientific_nanodrop_8000", - "ASM converter version": "0.1.62" + "ASM converter version": "0.1.106" }, "calculated data aggregate document": { "calculated data document": [ diff --git a/tests/parsers/thermo_fisher_nanodrop_8000/testdata/Thermo_NanoDrop_8000_example04.json b/tests/parsers/thermo_fisher_nanodrop_8000/testdata/Thermo_NanoDrop_8000_example04.json index 59eb3aaf36..1944e281d2 100644 --- a/tests/parsers/thermo_fisher_nanodrop_8000/testdata/Thermo_NanoDrop_8000_example04.json +++ b/tests/parsers/thermo_fisher_nanodrop_8000/testdata/Thermo_NanoDrop_8000_example04.json @@ -15,6 +15,12 @@ "detector wavelength setting": { "value": 260, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 260.0, + "unit": "nm" + } } } ] @@ -33,9 +39,25 @@ "mass concentration": { "value": 542.7, "unit": "ng/µL" + }, + "custom information document": { + "conc. factor": { + "value": 50.0, + "unit": "ng/µL" + } } } ] + }, + "custom information document": { + "340 raw": { + "value": 0.016, + "unit": "mAU" + }, + "Cursor Abs.": { + "value": 10.854, + "unit": "mAU" + } } }, { @@ -47,6 +69,12 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 260.0, + "unit": "nm" + } } } ] @@ -58,6 +86,12 @@ "absorbance": { "value": 5.978, "unit": "mAU" + }, + "custom information document": { + "Cursor Abs.": { + "value": 10.854, + "unit": "mAU" + } } } ], @@ -78,6 +112,12 @@ "detector wavelength setting": { "value": 260, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 260.0, + "unit": "nm" + } } } ] @@ -96,9 +136,25 @@ "mass concentration": { "value": 581.2, "unit": "ng/µL" + }, + "custom information document": { + "conc. factor": { + "value": 50.0, + "unit": "ng/µL" + } } } ] + }, + "custom information document": { + "340 raw": { + "value": 0.006, + "unit": "mAU" + }, + "Cursor Abs.": { + "value": 11.625, + "unit": "mAU" + } } }, { @@ -110,6 +166,12 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 260.0, + "unit": "nm" + } } } ] @@ -121,6 +183,12 @@ "absorbance": { "value": 6.413, "unit": "mAU" + }, + "custom information document": { + "Cursor Abs.": { + "value": 11.625, + "unit": "mAU" + } } } ], @@ -141,6 +209,12 @@ "detector wavelength setting": { "value": 260, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 260.0, + "unit": "nm" + } } } ] @@ -159,9 +233,25 @@ "mass concentration": { "value": 311.6, "unit": "ng/µL" + }, + "custom information document": { + "conc. factor": { + "value": 50.0, + "unit": "ng/µL" + } } } ] + }, + "custom information document": { + "340 raw": { + "value": -0.023, + "unit": "mAU" + }, + "Cursor Abs.": { + "value": 6.233, + "unit": "mAU" + } } }, { @@ -173,6 +263,12 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 260.0, + "unit": "nm" + } } } ] @@ -184,6 +280,12 @@ "absorbance": { "value": 3.376, "unit": "mAU" + }, + "custom information document": { + "Cursor Abs.": { + "value": 6.233, + "unit": "mAU" + } } } ], @@ -204,6 +306,12 @@ "detector wavelength setting": { "value": 260, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 260.0, + "unit": "nm" + } } } ] @@ -222,9 +330,25 @@ "mass concentration": { "value": 484.6, "unit": "ng/µL" + }, + "custom information document": { + "conc. factor": { + "value": 50.0, + "unit": "ng/µL" + } } } ] + }, + "custom information document": { + "340 raw": { + "value": 0.012, + "unit": "mAU" + }, + "Cursor Abs.": { + "value": 9.693, + "unit": "mAU" + } } }, { @@ -236,6 +360,12 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 260.0, + "unit": "nm" + } } } ] @@ -247,6 +377,12 @@ "absorbance": { "value": 5.315, "unit": "mAU" + }, + "custom information document": { + "Cursor Abs.": { + "value": 9.693, + "unit": "mAU" + } } } ], @@ -267,6 +403,12 @@ "detector wavelength setting": { "value": 260, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 260.0, + "unit": "nm" + } } } ] @@ -285,9 +427,25 @@ "mass concentration": { "value": 464.0, "unit": "ng/µL" + }, + "custom information document": { + "conc. factor": { + "value": 50.0, + "unit": "ng/µL" + } } } ] + }, + "custom information document": { + "340 raw": { + "value": 0.007, + "unit": "mAU" + }, + "Cursor Abs.": { + "value": 9.28, + "unit": "mAU" + } } }, { @@ -299,6 +457,12 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 260.0, + "unit": "nm" + } } } ] @@ -310,6 +474,12 @@ "absorbance": { "value": 5.049, "unit": "mAU" + }, + "custom information document": { + "Cursor Abs.": { + "value": 9.28, + "unit": "mAU" + } } } ], @@ -330,6 +500,12 @@ "detector wavelength setting": { "value": 260, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 260.0, + "unit": "nm" + } } } ] @@ -348,9 +524,25 @@ "mass concentration": { "value": 319.8, "unit": "ng/µL" + }, + "custom information document": { + "conc. factor": { + "value": 50.0, + "unit": "ng/µL" + } } } ] + }, + "custom information document": { + "340 raw": { + "value": 0.014, + "unit": "mAU" + }, + "Cursor Abs.": { + "value": 6.396, + "unit": "mAU" + } } }, { @@ -362,6 +554,12 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 260.0, + "unit": "nm" + } } } ] @@ -373,6 +571,12 @@ "absorbance": { "value": 3.464, "unit": "mAU" + }, + "custom information document": { + "Cursor Abs.": { + "value": 6.396, + "unit": "mAU" + } } } ], @@ -393,6 +597,12 @@ "detector wavelength setting": { "value": 260, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 260.0, + "unit": "nm" + } } } ] @@ -411,9 +621,25 @@ "mass concentration": { "value": 446.8, "unit": "ng/µL" + }, + "custom information document": { + "conc. factor": { + "value": 50.0, + "unit": "ng/µL" + } } } ] + }, + "custom information document": { + "340 raw": { + "value": 0.023, + "unit": "mAU" + }, + "Cursor Abs.": { + "value": 8.936, + "unit": "mAU" + } } }, { @@ -425,6 +651,12 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 260.0, + "unit": "nm" + } } } ] @@ -436,6 +668,12 @@ "absorbance": { "value": 4.871, "unit": "mAU" + }, + "custom information document": { + "Cursor Abs.": { + "value": 8.936, + "unit": "mAU" + } } } ], @@ -456,6 +694,12 @@ "detector wavelength setting": { "value": 260, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 260.0, + "unit": "nm" + } } } ] @@ -474,9 +718,25 @@ "mass concentration": { "value": 486.4, "unit": "ng/µL" + }, + "custom information document": { + "conc. factor": { + "value": 50.0, + "unit": "ng/µL" + } } } ] + }, + "custom information document": { + "340 raw": { + "value": 0.095, + "unit": "mAU" + }, + "Cursor Abs.": { + "value": 9.728, + "unit": "mAU" + } } }, { @@ -488,6 +748,12 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 260.0, + "unit": "nm" + } } } ] @@ -499,6 +765,12 @@ "absorbance": { "value": 5.328, "unit": "mAU" + }, + "custom information document": { + "Cursor Abs.": { + "value": 9.728, + "unit": "mAU" + } } } ], @@ -519,6 +791,12 @@ "detector wavelength setting": { "value": 260, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 260.0, + "unit": "nm" + } } } ] @@ -537,9 +815,25 @@ "mass concentration": { "value": 498.5, "unit": "ng/µL" + }, + "custom information document": { + "conc. factor": { + "value": 50.0, + "unit": "ng/µL" + } } } ] + }, + "custom information document": { + "340 raw": { + "value": -0.032, + "unit": "mAU" + }, + "Cursor Abs.": { + "value": 9.97, + "unit": "mAU" + } } }, { @@ -551,6 +845,12 @@ "detector wavelength setting": { "value": 280, "unit": "nm" + }, + "custom information document": { + "Cursor Pos.": { + "value": 260.0, + "unit": "nm" + } } } ] @@ -562,6 +862,12 @@ "absorbance": { "value": 5.449, "unit": "mAU" + }, + "custom information document": { + "Cursor Abs.": { + "value": 9.97, + "unit": "mAU" + } } } ], @@ -578,7 +884,7 @@ "file name": "Thermo_NanoDrop_8000_example04.txt", "UNC path": "tests/parsers/thermo_fisher_nanodrop_8000/testdata/Thermo_NanoDrop_8000_example04.txt", "ASM converter name": "allotropy_thermo_fisher_scientific_nanodrop_8000", - "ASM converter version": "0.1.62" + "ASM converter version": "0.1.106" }, "calculated data aggregate document": { "calculated data document": [ diff --git a/tests/parsers/thermo_fisher_nanodrop_8000/testdata/Thermo_NanoDrop_mRNA.json b/tests/parsers/thermo_fisher_nanodrop_8000/testdata/Thermo_NanoDrop_mRNA.json index 8a00c51523..f365946349 100644 --- a/tests/parsers/thermo_fisher_nanodrop_8000/testdata/Thermo_NanoDrop_mRNA.json +++ b/tests/parsers/thermo_fisher_nanodrop_8000/testdata/Thermo_NanoDrop_mRNA.json @@ -33,9 +33,21 @@ "mass concentration": { "value": 0.3929, "unit": "mg/mL" + }, + "custom information document": { + "ext.c.": { + "value": 25.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 0.982, + "unit": "mAU" + } } }, { @@ -58,6 +70,12 @@ "absorbance": { "value": 0.678, "unit": "mAU" + }, + "custom information document": { + "Cursor Abs.": { + "value": 0.982, + "unit": "mAU" + } } } ] @@ -88,6 +106,12 @@ "absorbance": { "value": 0.0, "unit": "mAU" + }, + "custom information document": { + "Cursor Abs.": { + "value": 0.982, + "unit": "mAU" + } } }, { @@ -110,6 +134,12 @@ "absorbance": { "value": 0.0, "unit": "mAU" + }, + "custom information document": { + "Cursor Abs.": { + "value": 0.982, + "unit": "mAU" + } } } ] @@ -147,9 +177,21 @@ "mass concentration": { "value": 0.6844, "unit": "mg/mL" + }, + "custom information document": { + "ext.c.": { + "value": 25.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 1.711, + "unit": "mAU" + } } }, { @@ -172,6 +214,12 @@ "absorbance": { "value": 1.016, "unit": "mAU" + }, + "custom information document": { + "Cursor Abs.": { + "value": 1.711, + "unit": "mAU" + } } } ] @@ -209,9 +257,21 @@ "mass concentration": { "value": 0.6685, "unit": "mg/mL" + }, + "custom information document": { + "ext.c.": { + "value": 25.0, + "unit": "M-1cm-1" + } } } ] + }, + "custom information document": { + "Cursor Abs.": { + "value": 1.671, + "unit": "mAU" + } } }, { @@ -234,6 +294,12 @@ "absorbance": { "value": 1.182, "unit": "mAU" + }, + "custom information document": { + "Cursor Abs.": { + "value": 1.671, + "unit": "mAU" + } } } ] @@ -249,7 +315,7 @@ "file name": "Thermo_NanoDrop_mRNA.txt", "UNC path": "tests/parsers/thermo_fisher_nanodrop_8000/testdata/Thermo_NanoDrop_mRNA.txt", "ASM converter name": "allotropy_thermo_fisher_scientific_nanodrop_8000", - "ASM converter version": "0.1.62" + "ASM converter version": "0.1.106" }, "calculated data aggregate document": { "calculated data document": [