labimotion 0.3.3 → 1.0.0
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- checksums.yaml +4 -4
- data/lib/labimotion/api.rb +19 -0
- data/lib/labimotion/apis/generic_dataset_api.rb +3 -4
- data/lib/labimotion/apis/generic_element_api.rb +8 -56
- data/lib/labimotion/apis/labimotion_hub_api.rb +4 -13
- data/lib/labimotion/apis/segment_api.rb +3 -4
- data/lib/labimotion/entities/element_entity.rb +0 -1
- data/lib/labimotion/entities/generic_public_entity.rb +0 -2
- data/lib/labimotion/helpers/dataset_helpers.rb +6 -14
- data/lib/labimotion/helpers/element_helpers.rb +10 -30
- data/lib/labimotion/helpers/generic_helpers.rb +13 -13
- data/lib/labimotion/helpers/segment_helpers.rb +8 -20
- data/lib/labimotion/libs/converter.rb +27 -53
- data/lib/labimotion/libs/export_dataset.rb +3 -8
- data/lib/labimotion/libs/nmr_mapper.rb +15 -39
- data/lib/labimotion/libs/nmr_mapper_repo.rb +278 -0
- data/lib/labimotion/libs/template_hub.rb +4 -8
- data/lib/labimotion/models/concerns/attachment_converter.rb +9 -10
- data/lib/labimotion/models/concerns/datasetable.rb +1 -1
- data/lib/labimotion/models/concerns/segmentable.rb +4 -3
- data/lib/labimotion/models/concerns/workflow.rb +0 -9
- data/lib/labimotion/models/element.rb +8 -17
- data/lib/labimotion/models/element_klass.rb +8 -0
- data/lib/labimotion/models/segment_klass.rb +0 -2
- data/lib/labimotion/{collection → utils}/export.rb +1 -32
- data/lib/labimotion/{collection → utils}/import.rb +71 -53
- data/lib/labimotion/version.rb +3 -7
- data/lib/labimotion.rb +2 -5
- metadata +10 -10
- data/lib/labimotion/models/hub_log.rb +0 -8
- data/lib/labimotion/utils/import_utils.rb +0 -116
@@ -7,12 +7,10 @@ module Labimotion
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|
7
7
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class Element < ApplicationRecord
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8
8
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acts_as_paranoid
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9
9
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self.table_name = :elements
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10
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-
include PgSearch
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11
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-
include PgSearch::Model if Labimotion::IS_RAILS5 == false
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10
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+
include PgSearch::Model
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12
11
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include ElementUIStateScopes
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13
12
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include Collectable
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14
13
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## include AnalysisCodes
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15
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-
include ElementCodes
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16
14
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include Taggable
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17
15
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include Workflow
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18
16
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include Segmentable
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@@ -59,7 +57,7 @@ module Labimotion
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59
57
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60
58
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61
59
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def attachments
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62
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-
Attachment.where(attachable_id: self.id, attachable_type:
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60
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+
Attachment.where(attachable_id: self.id, attachable_type: 'Element')
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63
61
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end
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64
62
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65
63
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def self.get_associated_samples(element_ids)
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@@ -101,20 +99,13 @@ module Labimotion
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101
99
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end
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102
100
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103
101
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def thumb_svg
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104
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-
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105
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-
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106
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-
a_img&.content_type&.match(Regexp.union(%w[jpg jpeg png tiff tif]))
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107
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-
end
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108
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-
|
109
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-
attachment = image_atts[0] || attachments[0]
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110
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-
preview = attachment.read_thumbnail if attachment
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111
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-
preview && Base64.encode64(preview) || 'not available'
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112
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-
else
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113
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-
image_atts = attachments.select(&:type_image?)
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114
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-
attachment = image_atts[0] || attachments[0]
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115
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-
preview = attachment&.read_thumbnail
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116
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-
(preview && Base64.encode64(preview)) || 'not available'
|
102
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+
image_atts = attachments.select do |a_img|
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103
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+
a_img&.content_type&.match(Regexp.union(%w[jpg jpeg png tiff tif]))
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117
104
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end
|
105
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+
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106
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+
attachment = image_atts[0] || attachments[0]
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+
preview = attachment.read_thumbnail if attachment
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108
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+
preview && Base64.encode64(preview) || 'not available'
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118
109
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end
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119
110
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120
111
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@@ -23,5 +23,13 @@ module Labimotion
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23
23
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)
|
24
24
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end
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25
25
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26
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+
def migrate_workflow
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27
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+
return if properties_template.nil? || properties_release.nil?
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28
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+
|
29
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+
return if properties_template['flow'].nil? && properties_release['flow'].nil?
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30
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+
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31
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+
update_column(:properties_template, split_workflow(properties_template)) if properties_template['flow']
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32
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+
update_column(:properties_release, split_workflow(properties_release)) if properties_release['flow']
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33
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+
end
|
26
34
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end
|
27
35
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end
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@@ -1,13 +1,11 @@
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1
1
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# frozen_string_literal: true
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2
2
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require 'labimotion/models/concerns/generic_klass_revisions'
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3
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-
require 'labimotion/models/concerns/workflow'
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4
3
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5
4
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module Labimotion
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6
5
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class SegmentKlass < ApplicationRecord
|
7
6
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self.table_name = :segment_klasses
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8
7
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acts_as_paranoid
|
9
8
|
include GenericKlassRevisions
|
10
|
-
include Workflow
|
11
9
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belongs_to :element_klass, class_name: 'Labimotion::ElementKlass'
|
12
10
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has_many :segments, dependent: :destroy, class_name: 'Labimotion::Segment'
|
13
11
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has_many :segment_klasses_revisions, dependent: :destroy, class_name: 'Labimotion::SegmentKlassesRevision'
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@@ -22,29 +22,6 @@ module Labimotion
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22
22
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fetch_many.call(klasses, {'created_by' => 'User'})
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23
23
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end
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24
24
|
|
25
|
-
def self.fetch_elements(collection, segments, attachments, fetch_many, fetch_one, fetch_containers)
|
26
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-
# fetch_many.call(collection.elements, {
|
27
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-
# 'element_klass_id' => 'Labimotion::ElementKlass',
|
28
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-
# 'created_by' => 'User',
|
29
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-
# })
|
30
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-
# fetch_many.call(collection.collections_elements, {
|
31
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-
# 'collection_id' => 'Collection',
|
32
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-
# 'element_id' => 'Labimotion::Element',
|
33
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-
# })
|
34
|
-
collection.elements.each do |element|
|
35
|
-
element, attachments = Labimotion::Export.fetch_properties(data, element, attachments, &fetch_one)
|
36
|
-
fetch_one.call(element, {
|
37
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-
'element_klass_id' => 'Labimotion::ElementKlass',
|
38
|
-
'created_by' => 'User',
|
39
|
-
})
|
40
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-
fetch_containers.call(element)
|
41
|
-
segment, @attachments = Labimotion::Export.fetch_segments(element, attachments, &fetch_one)
|
42
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-
segments += segment if segment.present?
|
43
|
-
end
|
44
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-
|
45
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-
[segments, attachments]
|
46
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-
|
47
|
-
end
|
48
25
|
|
49
26
|
def self.fetch_segments(element, attachments, &fetch_one)
|
50
27
|
element_type = element.class.name
|
@@ -94,15 +71,6 @@ module Labimotion
|
|
94
71
|
mol = Molecule.find(id) unless id.nil?
|
95
72
|
properties['layers'][key]['fields'][idx]['value']['el_id'] = fetch_one.call(mol) unless mol.nil?
|
96
73
|
end
|
97
|
-
|
98
|
-
field_samples = layer['fields'].select { |ss| ss['type'] == 'drag_sample' }
|
99
|
-
field_samples.each do |field|
|
100
|
-
# idx = properties['layers'][key]['fields'].index(field)
|
101
|
-
# id = field["value"] && field["value"]["el_id"] unless idx.nil?
|
102
|
-
# ss = Sample.find(id) unless id.nil?
|
103
|
-
# properties['layers'][key]['fields'][idx]['value']['el_id'] = fetch_one.call(ss) unless ss.nil?
|
104
|
-
end
|
105
|
-
|
106
74
|
field_uploads = layer['fields'].select { |ss| ss['type'] == 'upload' }
|
107
75
|
field_uploads.each do |upload|
|
108
76
|
idx = properties['layers'][key]['fields'].index(upload)
|
@@ -135,6 +103,7 @@ module Labimotion
|
|
135
103
|
end
|
136
104
|
end
|
137
105
|
end
|
106
|
+
|
138
107
|
end
|
139
108
|
instance.properties = properties
|
140
109
|
[instance, attachments]
|
@@ -1,6 +1,5 @@
|
|
1
1
|
# frozen_string_literal: true
|
2
2
|
|
3
|
-
require 'labimotion/utils/import_utils'
|
4
3
|
module Labimotion
|
5
4
|
class Import
|
6
5
|
|
@@ -51,7 +50,7 @@ module Labimotion
|
|
51
50
|
element_type = fields.fetch('element_type')
|
52
51
|
element = instances.fetch(element_type).fetch(element_uuid)
|
53
52
|
|
54
|
-
dataset_klass = Labimotion::DatasetKlass.find_by(identifier: dk_id)
|
53
|
+
dataset_klass = Labimotion::DatasetKlass.find_by(identifier: dk_id)
|
55
54
|
next if gt == true && dataset_klass.nil?
|
56
55
|
|
57
56
|
dkr = Labimotion::DatasetKlassesRevision.find_by(uuid: fields.fetch('klass_uuid'))
|
@@ -89,21 +88,33 @@ module Labimotion
|
|
89
88
|
ek_obj = data.fetch('Labimotion::ElementKlass').fetch(sk_obj["element_klass_id"])
|
90
89
|
element_klass = Labimotion::ElementKlass.find_by(name: ek_obj['name']) if ek_obj.present?
|
91
90
|
next if element_klass.nil? || ek_obj.nil? || ek_obj['is_generic'] == true
|
92
|
-
|
93
91
|
element_uuid = fields.fetch('element_id')
|
94
92
|
element_type = fields.fetch('element_type')
|
95
93
|
element = instances.fetch(element_type).fetch(element_uuid)
|
96
|
-
segment_klass = Labimotion::SegmentKlass.find_by(identifier: sk_id)
|
97
|
-
|
98
|
-
|
99
|
-
|
100
|
-
|
101
|
-
|
102
|
-
|
103
|
-
|
104
|
-
|
105
|
-
|
106
|
-
|
94
|
+
segment_klass = Labimotion::SegmentKlass.find_by(identifier: sk_id)
|
95
|
+
next if gt == true && segment_klass.nil?
|
96
|
+
|
97
|
+
skr = Labimotion::SegmentKlassesRevision.find_by(uuid: fields.fetch('klass_uuid'))
|
98
|
+
segment_klass = skr.segment_klass if segment_klass.nil? && skr.present?
|
99
|
+
|
100
|
+
# segment_klass = Labimotion::SegmentKlass.create!(sk_obj.slice(
|
101
|
+
# 'label',
|
102
|
+
# 'desc',
|
103
|
+
# 'properties_template',
|
104
|
+
# 'is_active',
|
105
|
+
# 'place',
|
106
|
+
# 'properties_release',
|
107
|
+
# 'uuid',
|
108
|
+
# 'identifier',
|
109
|
+
# 'sync_time'
|
110
|
+
# ).merge(
|
111
|
+
# element_klass: element_klass,
|
112
|
+
# created_by: current_user_id,
|
113
|
+
# released_at: DateTime.now
|
114
|
+
# )
|
115
|
+
# ) if segment_klass.nil?
|
116
|
+
|
117
|
+
next if segment_klass.nil?
|
107
118
|
|
108
119
|
segment = Labimotion::Segment.create!(
|
109
120
|
fields.slice(
|
@@ -117,7 +128,52 @@ module Labimotion
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|
117
128
|
)
|
118
129
|
)
|
119
130
|
|
120
|
-
properties =
|
131
|
+
properties = segment.properties
|
132
|
+
properties['layers'].keys.each do |key|
|
133
|
+
layer = properties['layers'][key]
|
134
|
+
field_molecules = layer['fields'].select { |ss| ss['type'] == 'drag_molecule' }
|
135
|
+
field_molecules.each do |field|
|
136
|
+
idx = properties['layers'][key]['fields'].index(field)
|
137
|
+
id = field["value"] && field["value"]["el_id"] unless idx.nil?
|
138
|
+
mol = Molecule.find_or_create_by_molfile(data.fetch('Molecule')[id]['molfile']) unless id.nil?
|
139
|
+
unless mol.nil?
|
140
|
+
properties['layers'][key]['fields'][idx]['value']['el_id'] = mol.id
|
141
|
+
properties['layers'][key]['fields'][idx]['value']['el_tip'] = "#{mol.inchikey}@@#{mol.cano_smiles}"
|
142
|
+
properties['layers'][key]['fields'][idx]['value']['el_label'] = mol.iupac_name
|
143
|
+
end
|
144
|
+
end
|
145
|
+
|
146
|
+
field_tables = layer['fields'].select { |ss| ss['type'] == 'table' }
|
147
|
+
field_tables&.each do |field|
|
148
|
+
tidx = layer['fields'].index(field)
|
149
|
+
next unless field['sub_values'].present? && field['sub_fields'].present?
|
150
|
+
|
151
|
+
field_table_molecules = field['sub_fields'].select { |ss| ss['type'] == 'drag_molecule' }
|
152
|
+
if field_table_molecules.present?
|
153
|
+
col_ids = field_table_molecules.map { |x| x.values[0] }
|
154
|
+
col_ids.each do |col_id|
|
155
|
+
field['sub_values'].each_with_index do |sub_value, vdx|
|
156
|
+
next unless sub_value[col_id].present? && sub_value[col_id]['value'].present? && sub_value[col_id]['value']['el_id'].present?
|
157
|
+
|
158
|
+
svalue = sub_value[col_id]['value']
|
159
|
+
next unless svalue['el_id'].present? && svalue['el_inchikey'].present?
|
160
|
+
|
161
|
+
tmol = Molecule.find_or_create_by_molfile(data.fetch('Molecule')[svalue['el_id']]['molfile']) unless svalue['el_id'].nil?
|
162
|
+
unless tmol.nil?
|
163
|
+
properties['layers'][key]['fields'][tidx]['sub_values'][vdx][col_id]['value']['el_id'] = tmol.id
|
164
|
+
properties['layers'][key]['fields'][tidx]['sub_values'][vdx][col_id]['value']['el_tip'] = "#{tmol.inchikey}@@#{tmol.cano_smiles}"
|
165
|
+
properties['layers'][key]['fields'][tidx]['sub_values'][vdx][col_id]['value']['el_label'] = tmol.cano_smiles
|
166
|
+
properties['layers'][key]['fields'][tidx]['sub_values'][vdx][col_id]['value']['el_smiles'] = tmol.cano_smiles
|
167
|
+
properties['layers'][key]['fields'][tidx]['sub_values'][vdx][col_id]['value']['el_iupac'] = tmol.iupac_name
|
168
|
+
properties['layers'][key]['fields'][tidx]['sub_values'][vdx][col_id]['value']['el_inchikey'] = tmol.inchikey
|
169
|
+
properties['layers'][key]['fields'][tidx]['sub_values'][vdx][col_id]['value']['el_svg'] = File.join('/images', 'molecules', tmol.molecule_svg_file)
|
170
|
+
properties['layers'][key]['fields'][tidx]['sub_values'][vdx][col_id]['value']['el_molecular_weight'] = tmol.molecular_weight
|
171
|
+
end
|
172
|
+
end
|
173
|
+
end
|
174
|
+
end
|
175
|
+
end
|
176
|
+
end
|
121
177
|
segment.update!(properties: properties)
|
122
178
|
update_instances.call(uuid, segment)
|
123
179
|
end
|
@@ -126,43 +182,5 @@ module Labimotion
|
|
126
182
|
raise
|
127
183
|
end
|
128
184
|
end
|
129
|
-
|
130
|
-
def self.import_elements(data, instances, gt, current_user_id, fetch_many, &update_instances)
|
131
|
-
data.fetch('Labimotion::Element', {}).each do |uuid, fields|
|
132
|
-
klass_id = fields["element_klass_id"]
|
133
|
-
ek_obj = data.fetch('Labimotion::ElementKlass', {})[klass_id]
|
134
|
-
ek_id = ek_obj["identifier"]
|
135
|
-
element_klass = Labimotion::ElementKlass.find_by(identifier: ek_id) if ek_id.present?
|
136
|
-
element_klass = Labimotion::ElementKlass.find_by(uuid: fields.fetch('klass_uuid')) if element_klass.nil?
|
137
|
-
|
138
|
-
if element_klass.nil?
|
139
|
-
ekr = Labimotion::ElementKlassesRevision.find_by(uuid: fields.fetch('klass_uuid'))
|
140
|
-
element_klass = ekr.element_klass if element_klass.nil? && ekr.present?
|
141
|
-
end
|
142
|
-
next if element_klass.nil?
|
143
|
-
|
144
|
-
element = Labimotion::Element.create!(
|
145
|
-
fields.slice(
|
146
|
-
'name', 'properties', 'properties_release'
|
147
|
-
).merge(
|
148
|
-
created_by: current_user_id,
|
149
|
-
element_klass: element_klass,
|
150
|
-
collections: fetch_many.call(
|
151
|
-
'Collection', 'Labimotion::CollectionsElement', 'element_id', 'collection_id', uuid
|
152
|
-
),
|
153
|
-
uuid: SecureRandom.uuid,
|
154
|
-
klass_uuid: ekr&.uuid || element_klass.uuid
|
155
|
-
)
|
156
|
-
)
|
157
|
-
|
158
|
-
properties = Labimotion::ImportUtils.properties_handler(data, element.properties)
|
159
|
-
element.update!(properties: properties)
|
160
|
-
update_instances.call(uuid, element)
|
161
|
-
element.container = Container.create_root_container
|
162
|
-
end
|
163
|
-
rescue StandardError => e
|
164
|
-
Rails.logger.error(e.backtrace)
|
165
|
-
raise
|
166
|
-
end
|
167
185
|
end
|
168
186
|
end
|
data/lib/labimotion/version.rb
CHANGED
@@ -1,11 +1,7 @@
|
|
1
1
|
# frozen_string_literal: true
|
2
2
|
|
3
|
-
## Labimotion Version
|
4
3
|
module Labimotion
|
5
|
-
|
6
|
-
|
7
|
-
|
8
|
-
|
9
|
-
VERSION = Labimotion::VERSION_REPO if Labimotion::IS_RAILS5 == true
|
10
|
-
VERSION = Labimotion::VERSION_ELN if Labimotion::IS_RAILS5 == false
|
4
|
+
# VERSION = '0.1.4'
|
5
|
+
VERSION = '1.0.0'
|
6
|
+
IS_RAILS5 = false
|
11
7
|
end
|
data/lib/labimotion.rb
CHANGED
@@ -61,11 +61,8 @@ module Labimotion
|
|
61
61
|
autoload :ConState, 'labimotion/utils/con_state'
|
62
62
|
autoload :Serializer, 'labimotion/utils/serializer'
|
63
63
|
autoload :Search, 'labimotion/utils/search'
|
64
|
-
|
65
|
-
|
66
|
-
######## Collection
|
67
|
-
autoload :Export, 'labimotion/collection/export'
|
68
|
-
autoload :Import, 'labimotion/collection/import'
|
64
|
+
autoload :Export, 'labimotion/utils/export'
|
65
|
+
autoload :Import, 'labimotion/utils/import'
|
69
66
|
|
70
67
|
######## Models
|
71
68
|
autoload :Element, 'labimotion/models/element'
|
metadata
CHANGED
@@ -1,7 +1,7 @@
|
|
1
1
|
--- !ruby/object:Gem::Specification
|
2
2
|
name: labimotion
|
3
3
|
version: !ruby/object:Gem::Version
|
4
|
-
version: 0.
|
4
|
+
version: 1.0.0
|
5
5
|
platform: ruby
|
6
6
|
authors:
|
7
7
|
- Chia-Lin Lin
|
@@ -9,7 +9,7 @@ authors:
|
|
9
9
|
autorequire:
|
10
10
|
bindir: bin
|
11
11
|
cert_chain: []
|
12
|
-
date: 2023-
|
12
|
+
date: 2023-08-24 00:00:00.000000000 Z
|
13
13
|
dependencies:
|
14
14
|
- !ruby/object:Gem::Dependency
|
15
15
|
name: rails
|
@@ -17,14 +17,14 @@ dependencies:
|
|
17
17
|
requirements:
|
18
18
|
- - "~>"
|
19
19
|
- !ruby/object:Gem::Version
|
20
|
-
version:
|
20
|
+
version: 6.1.7
|
21
21
|
type: :runtime
|
22
22
|
prerelease: false
|
23
23
|
version_requirements: !ruby/object:Gem::Requirement
|
24
24
|
requirements:
|
25
25
|
- - "~>"
|
26
26
|
- !ruby/object:Gem::Version
|
27
|
-
version:
|
27
|
+
version: 6.1.7
|
28
28
|
description:
|
29
29
|
email:
|
30
30
|
- chia-lin.lin@kit.edu
|
@@ -34,13 +34,12 @@ extensions: []
|
|
34
34
|
extra_rdoc_files: []
|
35
35
|
files:
|
36
36
|
- lib/labimotion.rb
|
37
|
+
- lib/labimotion/api.rb
|
37
38
|
- lib/labimotion/apis/converter_api.rb
|
38
39
|
- lib/labimotion/apis/generic_dataset_api.rb
|
39
40
|
- lib/labimotion/apis/generic_element_api.rb
|
40
41
|
- lib/labimotion/apis/labimotion_hub_api.rb
|
41
42
|
- lib/labimotion/apis/segment_api.rb
|
42
|
-
- lib/labimotion/collection/export.rb
|
43
|
-
- lib/labimotion/collection/import.rb
|
44
43
|
- lib/labimotion/entities/application_entity.rb
|
45
44
|
- lib/labimotion/entities/dataset_entity.rb
|
46
45
|
- lib/labimotion/entities/dataset_klass_entity.rb
|
@@ -66,6 +65,7 @@ files:
|
|
66
65
|
- lib/labimotion/libs/converter.rb
|
67
66
|
- lib/labimotion/libs/export_dataset.rb
|
68
67
|
- lib/labimotion/libs/nmr_mapper.rb
|
68
|
+
- lib/labimotion/libs/nmr_mapper_repo.rb
|
69
69
|
- lib/labimotion/libs/template_hub.rb
|
70
70
|
- lib/labimotion/models/collections_element.rb
|
71
71
|
- lib/labimotion/models/concerns/attachment_converter.rb
|
@@ -84,20 +84,20 @@ files:
|
|
84
84
|
- lib/labimotion/models/elements_element.rb
|
85
85
|
- lib/labimotion/models/elements_revision.rb
|
86
86
|
- lib/labimotion/models/elements_sample.rb
|
87
|
-
- lib/labimotion/models/hub_log.rb
|
88
87
|
- lib/labimotion/models/segment.rb
|
89
88
|
- lib/labimotion/models/segment_klass.rb
|
90
89
|
- lib/labimotion/models/segment_klasses_revision.rb
|
91
90
|
- lib/labimotion/models/segments_revision.rb
|
92
91
|
- lib/labimotion/utils/con_state.rb
|
93
|
-
- lib/labimotion/utils/
|
92
|
+
- lib/labimotion/utils/export.rb
|
93
|
+
- lib/labimotion/utils/import.rb
|
94
94
|
- lib/labimotion/utils/search.rb
|
95
95
|
- lib/labimotion/utils/serializer.rb
|
96
96
|
- lib/labimotion/utils/utils.rb
|
97
97
|
- lib/labimotion/version.rb
|
98
|
-
homepage: https://
|
98
|
+
homepage: https://github.com/phuang26/labimotion
|
99
99
|
licenses:
|
100
|
-
-
|
100
|
+
- MIT
|
101
101
|
metadata: {}
|
102
102
|
post_install_message:
|
103
103
|
rdoc_options: []
|
@@ -1,116 +0,0 @@
|
|
1
|
-
# frozen_string_literal: true
|
2
|
-
|
3
|
-
module Labimotion
|
4
|
-
## Import Utils
|
5
|
-
class ImportUtils
|
6
|
-
def self.proc_sample(layer, key, data, properties)
|
7
|
-
field_samples = layer['fields'].select { |ss| ss['type'] == 'drag_sample' }
|
8
|
-
field_samples.each do |field|
|
9
|
-
idx = properties['layers'][key]['fields'].index(field)
|
10
|
-
id = field["value"] && field["value"]["el_id"] unless idx.nil?
|
11
|
-
|
12
|
-
# mol = Molecule.find_or_create_by_molfile(data.fetch('Molecule')[id]['molfile']) unless id.nil?
|
13
|
-
# unless mol.nil?
|
14
|
-
# properties['layers'][key]['fields'][idx]['value']['el_id'] = mol.id
|
15
|
-
# properties['layers'][key]['fields'][idx]['value']['el_tip'] = "#{mol.inchikey}@@#{mol.cano_smiles}"
|
16
|
-
# properties['layers'][key]['fields'][idx]['value']['el_label'] = mol.iupac_name
|
17
|
-
# end
|
18
|
-
end
|
19
|
-
properties
|
20
|
-
rescue StandardError => e
|
21
|
-
Rails.logger.error(e.backtrace)
|
22
|
-
raise
|
23
|
-
end
|
24
|
-
|
25
|
-
def self.proc_molecule(layer, key, data, properties)
|
26
|
-
field_molecules = layer['fields'].select { |ss| ss['type'] == 'drag_molecule' }
|
27
|
-
field_molecules.each do |field|
|
28
|
-
idx = properties['layers'][key]['fields'].index(field)
|
29
|
-
id = field["value"] && field["value"]["el_id"] unless idx.nil?
|
30
|
-
mol = Molecule.find_or_create_by_molfile(data.fetch('Molecule')[id]['molfile']) unless id.nil?
|
31
|
-
unless mol.nil?
|
32
|
-
properties['layers'][key]['fields'][idx]['value']['el_id'] = mol.id
|
33
|
-
properties['layers'][key]['fields'][idx]['value']['el_tip'] = "#{mol.inchikey}@@#{mol.cano_smiles}"
|
34
|
-
properties['layers'][key]['fields'][idx]['value']['el_label'] = mol.iupac_name
|
35
|
-
end
|
36
|
-
end
|
37
|
-
properties
|
38
|
-
rescue StandardError => e
|
39
|
-
Rails.logger.error(e.backtrace)
|
40
|
-
raise
|
41
|
-
end
|
42
|
-
|
43
|
-
def self.proc_table(layer, key, data, properties)
|
44
|
-
field_tables = layer['fields'].select { |ss| ss['type'] == 'table' }
|
45
|
-
field_tables&.each do |field|
|
46
|
-
tidx = layer['fields'].index(field)
|
47
|
-
next unless field['sub_values'].present? && field['sub_fields'].present?
|
48
|
-
|
49
|
-
field_table_molecules = field['sub_fields'].select { |ss| ss['type'] == 'drag_molecule' }
|
50
|
-
if field_table_molecules.present?
|
51
|
-
col_ids = field_table_molecules.map { |x| x.values[0] }
|
52
|
-
col_ids.each do |col_id|
|
53
|
-
field['sub_values'].each_with_index do |sub_value, vdx|
|
54
|
-
next unless sub_value[col_id].present? && sub_value[col_id]['value'].present? && sub_value[col_id]['value']['el_id'].present?
|
55
|
-
|
56
|
-
svalue = sub_value[col_id]['value']
|
57
|
-
next unless svalue['el_id'].present? && svalue['el_inchikey'].present?
|
58
|
-
|
59
|
-
tmol = Molecule.find_or_create_by_molfile(data.fetch('Molecule')[svalue['el_id']]['molfile']) unless svalue['el_id'].nil?
|
60
|
-
unless tmol.nil?
|
61
|
-
properties['layers'][key]['fields'][tidx]['sub_values'][vdx][col_id]['value']['el_id'] = tmol.id
|
62
|
-
properties['layers'][key]['fields'][tidx]['sub_values'][vdx][col_id]['value']['el_tip'] = "#{tmol.inchikey}@@#{tmol.cano_smiles}"
|
63
|
-
properties['layers'][key]['fields'][tidx]['sub_values'][vdx][col_id]['value']['el_label'] = tmol.cano_smiles
|
64
|
-
properties['layers'][key]['fields'][tidx]['sub_values'][vdx][col_id]['value']['el_smiles'] = tmol.cano_smiles
|
65
|
-
properties['layers'][key]['fields'][tidx]['sub_values'][vdx][col_id]['value']['el_iupac'] = tmol.iupac_name
|
66
|
-
properties['layers'][key]['fields'][tidx]['sub_values'][vdx][col_id]['value']['el_inchikey'] = tmol.inchikey
|
67
|
-
properties['layers'][key]['fields'][tidx]['sub_values'][vdx][col_id]['value']['el_svg'] = File.join('/images', 'molecules', tmol.molecule_svg_file)
|
68
|
-
properties['layers'][key]['fields'][tidx]['sub_values'][vdx][col_id]['value']['el_molecular_weight'] = tmol.molecular_weight
|
69
|
-
end
|
70
|
-
end
|
71
|
-
end
|
72
|
-
end
|
73
|
-
end
|
74
|
-
properties
|
75
|
-
rescue StandardError => e
|
76
|
-
Rails.logger.error(e.backtrace)
|
77
|
-
raise
|
78
|
-
end
|
79
|
-
|
80
|
-
def self.properties_handler(data, properties)
|
81
|
-
properties && properties['layers'] && properties['layers'].keys&.each do |key|
|
82
|
-
layer = properties['layers'][key]
|
83
|
-
properties = proc_molecule(layer, key, data, properties)
|
84
|
-
properties = proc_table(layer, key, data, properties)
|
85
|
-
# properties = proc_sample(layer, key, data, properties)
|
86
|
-
end
|
87
|
-
properties
|
88
|
-
rescue StandardError => e
|
89
|
-
Rails.logger.error(e.backtrace)
|
90
|
-
raise
|
91
|
-
end
|
92
|
-
|
93
|
-
def self.create_segment_klass(sk_obj, segment_klass, element_klass, current_user_id)
|
94
|
-
return if segment_klass.present? || element_klass.nil? || sk_obj.nil?
|
95
|
-
|
96
|
-
segment_klass = Labimotion::SegmentKlass.create!(sk_obj.slice(
|
97
|
-
'label',
|
98
|
-
'desc',
|
99
|
-
'properties_template',
|
100
|
-
'is_active',
|
101
|
-
'place',
|
102
|
-
'properties_release',
|
103
|
-
'uuid',
|
104
|
-
'identifier',
|
105
|
-
'sync_time'
|
106
|
-
).merge(
|
107
|
-
element_klass: element_klass,
|
108
|
-
created_by: current_user_id,
|
109
|
-
released_at: DateTime.now
|
110
|
-
)
|
111
|
-
)
|
112
|
-
|
113
|
-
segment_klass
|
114
|
-
end
|
115
|
-
end
|
116
|
-
end
|