@mat3ra/esse 2025.8.9-0 → 2025.8.20-0

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Files changed (50) hide show
  1. package/dist/js/schema/software/template.json +4 -2
  2. package/dist/js/schema/software_directory/modeling/unit/execution.json +1 -2
  3. package/dist/js/schema/software_directory/scripting/unit/execution.json +1 -2
  4. package/dist/js/schema/workflow/unit/input/_input.json +1 -2
  5. package/dist/js/schema/workflow/unit/input/_inputItem.json +1 -2
  6. package/dist/js/schemas.json +1 -1
  7. package/dist/js/types.d.ts +6 -3303
  8. package/package.json +1 -1
  9. package/schema/software/template.json +3 -0
  10. package/schema/workflow/unit/input/_inputItem.json +1 -2
  11. package/dist/js/example/software_directory/ml/exabyteml.json +0 -6
  12. package/dist/js/example/software_directory/ml/unit/execution/evaluate/cross_validate.json +0 -20
  13. package/dist/js/example/software_directory/ml/unit/execution/initialize.json +0 -23
  14. package/dist/js/example/software_directory/ml/unit/execution/score.json +0 -18
  15. package/dist/js/example/software_directory/ml/unit/execution/train.json +0 -29
  16. package/dist/js/example/software_directory/ml/unit/processing/data_transformation/manipulation.json +0 -14
  17. package/dist/js/example/software_directory/ml/unit/processing/data_transformation/scale_and_reduce.json +0 -26
  18. package/dist/js/example/software_directory/ml/unit/processing/feature_selection/filter_based.json +0 -13
  19. package/dist/js/schema/software_directory/ml/exabyteml.json +0 -23
  20. package/dist/js/schema/software_directory/ml/unit/execution/evaluate/cross_validate.json +0 -657
  21. package/dist/js/schema/software_directory/ml/unit/execution/initialize.json +0 -661
  22. package/dist/js/schema/software_directory/ml/unit/execution/score.json +0 -647
  23. package/dist/js/schema/software_directory/ml/unit/execution/train.json +0 -670
  24. package/dist/js/schema/software_directory/ml/unit/execution.json +0 -2636
  25. package/dist/js/schema/software_directory/ml/unit/processing/data_transformation/manipulation.json +0 -269
  26. package/dist/js/schema/software_directory/ml/unit/processing/data_transformation/scale_and_reduce.json +0 -289
  27. package/dist/js/schema/software_directory/ml/unit/processing/data_transformation.json +0 -293
  28. package/dist/js/schema/software_directory/ml/unit/processing/feature_selection/filter_based.json +0 -264
  29. package/dist/js/schema/software_directory/ml/unit/processing/feature_selection.json +0 -268
  30. package/dist/js/schema/software_directory/ml/unit/processing.json +0 -564
  31. package/example/software_directory/ml/exabyteml.json +0 -6
  32. package/example/software_directory/ml/unit/execution/evaluate/cross-validate.json +0 -17
  33. package/example/software_directory/ml/unit/execution/initialize.json +0 -20
  34. package/example/software_directory/ml/unit/execution/score.json +0 -15
  35. package/example/software_directory/ml/unit/execution/train.json +0 -26
  36. package/example/software_directory/ml/unit/processing/data_transformation/manipulation.json +0 -14
  37. package/example/software_directory/ml/unit/processing/data_transformation/scale_and_reduce.json +0 -26
  38. package/example/software_directory/ml/unit/processing/feature_selection/filter_based.json +0 -13
  39. package/schema/software_directory/ml/exabyteml.json +0 -23
  40. package/schema/software_directory/ml/unit/execution/evaluate/cross-validate.json +0 -26
  41. package/schema/software_directory/ml/unit/execution/initialize.json +0 -30
  42. package/schema/software_directory/ml/unit/execution/score.json +0 -14
  43. package/schema/software_directory/ml/unit/execution/train.json +0 -39
  44. package/schema/software_directory/ml/unit/execution.json +0 -17
  45. package/schema/software_directory/ml/unit/processing/data_transformation/manipulation.json +0 -50
  46. package/schema/software_directory/ml/unit/processing/data_transformation/scale_and_reduce.json +0 -70
  47. package/schema/software_directory/ml/unit/processing/data_transformation.json +0 -8
  48. package/schema/software_directory/ml/unit/processing/feature_selection/filter_based.json +0 -45
  49. package/schema/software_directory/ml/unit/processing/feature_selection.json +0 -8
  50. package/schema/software_directory/ml/unit/processing.json +0 -11
package/package.json CHANGED
@@ -1,6 +1,6 @@
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  {
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  "name": "@mat3ra/esse",
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- "version": "2025.8.9-0",
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+ "version": "2025.8.20-0",
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  "description": "Mat3ra's Excellent Source of Schemas and Examples (ESSE) for Digital Materials R&D",
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  "scripts": {
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  "transpile": "tsc -p tsconfig-transpile.json",
@@ -27,6 +27,9 @@
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  "description": "render context provider names",
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  "$ref": "../workflow/unit/runtime/_runtime_item_name_object.json"
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  }
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+ },
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+ "isManuallyChanged": {
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+ "type": "boolean"
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  }
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  },
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  "required": [
@@ -19,7 +19,6 @@
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  },
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  "required": [
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  "name",
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- "content",
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- "rendered"
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+ "content"
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  ]
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  }
@@ -1,6 +0,0 @@
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- {
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- "name": "exabyteml",
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- "shortName": "ml",
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- "summary": "exabyte machine learning engine",
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- "version": "0.2.0"
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- }
@@ -1,20 +0,0 @@
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- {
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- "application": {
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- "name": "exabyteml",
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- "shortName": "ml",
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- "summary": "exabyte machine learning engine",
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- "version": "0.2.0"
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- },
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- "flavor": {
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- "executableId": "4987JFJ3kKbwvFSG7",
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- "name": "cross-validate"
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- },
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- "flowchartId": "evaluate",
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- "head": true,
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- "input": {
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- "nSplits": 3
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- },
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- "name": "evaluate",
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- "status": "idle",
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- "type": "execution"
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- }
@@ -1,23 +0,0 @@
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- {
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- "application": {
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- "name": "exabyteml",
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- "shortName": "ml",
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- "summary": "exabyte machine learning engine",
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- "version": "0.2.0"
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- },
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- "flavor": {
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- "executableId": "4987JFJ3kKbwvFSG7",
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- "name": "initialize"
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- },
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- "flowchartId": "initialize",
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- "head": true,
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- "input": {
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- "targets": [
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- "band_gaps:indirect",
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- "band_gaps:direct"
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- ]
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- },
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- "name": "initialize",
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- "status": "idle",
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- "type": "execution"
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- }
@@ -1,18 +0,0 @@
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- {
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- "application": {
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- "name": "exabyteml",
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- "shortName": "ml",
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- "summary": "exabyte machine learning engine",
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- "version": "0.2.0"
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- },
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- "flavor": {
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- "executableId": "4987JFJ3kKbwvFSG7",
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- "name": "score"
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- },
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- "flowchartId": "score",
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- "head": true,
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- "input": {},
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- "name": "score",
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- "status": "idle",
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- "type": "execution"
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- }
@@ -1,29 +0,0 @@
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- {
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- "application": {
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- "name": "exabyteml",
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- "shortName": "ml",
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- "summary": "exabyte machine learning engine",
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- "version": "0.2.0"
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- },
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- "flavor": {
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- "executableId": "4987JFJ3kKbwvFSG7",
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- "name": "train"
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- },
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- "flowchartId": "train",
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- "head": true,
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- "input": {
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- "features": [
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- "elemental_ratio:Si",
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- "elemental_ratio:Ge",
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- "ionization_potential:Ge",
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- "ionization_potential:Si"
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- ],
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- "targets": [
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- "band_gaps:indirect",
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- "band_gaps:direct"
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- ]
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- },
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- "name": "train",
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- "status": "idle",
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- "type": "execution"
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- }
@@ -1,14 +0,0 @@
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- {
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- "flowchartId": "data_transformation",
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- "head": true,
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- "inputData": {
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- "cleanMissingData": true,
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- "removeDuplicateRows": true,
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- "replaceNoneValuesWith": 0
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- },
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- "name": "data_transformation",
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- "operation": "data_transformation",
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- "operationType": "manipulation",
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- "status": "idle",
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- "type": "processing"
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- }
@@ -1,26 +0,0 @@
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- {
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- "flowchartId": "data_transformation",
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- "head": true,
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- "inputData": {
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- "perFeature": [
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- {
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- "mean": 0.156,
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- "name": "atomic_radius:Ge",
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- "scale": 1.5,
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- "variance": 0.1
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- },
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- {
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- "mean": 0.155,
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- "name": "atomic_radius:Si",
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- "scale": 1.4,
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- "variance": 0.11
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- }
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- ],
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- "scaler": "standard_scaler"
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- },
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- "name": "data_transformation",
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- "operation": "data_transformation",
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- "operationType": "scale_and_reduce",
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- "status": "idle",
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- "type": "processing"
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- }
@@ -1,13 +0,0 @@
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- {
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- "flowchartId": "feature_selection",
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- "head": true,
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- "inputData": {
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- "algorithm": "f_regression",
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- "nFeatures": 100
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- },
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- "name": "feature_selection",
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- "operation": "feature_selection",
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- "operationType": "filter_based",
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- "status": "idle",
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- "type": "processing"
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- }
@@ -1,23 +0,0 @@
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- {
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- "$id": "software-directory/ml/exabyteml",
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- "$schema": "http://json-schema.org/draft-07/schema#",
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- "title": "exabyte machine learning engine schema",
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- "type": "object",
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- "properties": {
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- "name": {
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- "enum": [
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- "exabyteml"
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- ]
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- },
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- "summary": {
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- "enum": [
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- "exabyte machine learning engine"
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- ]
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- },
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- "version": {
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- "enum": [
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- "0.2.0"
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- ]
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- }
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- }
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- }