labimotion 1.4.0.rc1 → 1.4.0.rc3

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checksums.yaml CHANGED
@@ -1,7 +1,7 @@
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@@ -23,7 +23,7 @@ module Labimotion
23
23
 
24
24
  object.properties[Labimotion::Prop::LAYERS][key][Labimotion::Prop::FIELDS][idx]['value']['el_label'] = el.short_label if field['type'] == Labimotion::FieldType::DRAG_SAMPLE
25
25
  object.properties[Labimotion::Prop::LAYERS][key][Labimotion::Prop::FIELDS][idx]['value']['el_tip'] = el.short_label if field['type'] == Labimotion::FieldType::DRAG_SAMPLE
26
- object.properties[Labimotion::Prop::LAYERS][key][Labimotion::Prop::FIELDS][idx]['value']['el_svg'] = field['type'] == Labimotion::FieldType::DRAG_SAMPLE ? el.get_svg_path : File.join('/images', 'molecules', el.molecule_svg_file)
26
+ object.properties[Labimotion::Prop::LAYERS][key][Labimotion::Prop::FIELDS][idx]['value']['el_svg'] = field['type'] == Labimotion::FieldType::DRAG_SAMPLE ? el.get_svg_path : File.join('/images', 'molecules', el&.molecule_svg_file || 'nosvg')
27
27
  end
28
28
 
29
29
  field_tables = object.properties[Labimotion::Prop::LAYERS][key][Labimotion::Prop::FIELDS].select { |ss| ss['type'] == Labimotion::FieldType::TABLE }
@@ -41,7 +41,7 @@ module Labimotion
41
41
  find_mol = Molecule.find_by(id: sub_value[col_id]['value']['el_id'])
42
42
  next unless find_mol.present?
43
43
 
44
- sub_value[col_id]['value']['el_svg'] = File.join('/images', 'molecules', find_mol.molecule_svg_file)
44
+ sub_value[col_id]['value']['el_svg'] = File.join('/images', 'molecules', find_mol.molecule_svg_file) if find_mol&.molecule_svg_file&.present?
45
45
  sub_value[col_id]['value']['el_inchikey'] = find_mol.inchikey
46
46
  sub_value[col_id]['value']['el_smiles'] = find_mol.cano_smiles
47
47
  sub_value[col_id]['value']['el_iupac'] = find_mol.iupac_name
@@ -47,7 +47,7 @@ module Labimotion
47
47
  el.short_label
48
48
  end
49
49
  object.properties[Labimotion::Prop::LAYERS][key][Labimotion::Prop::FIELDS][idx]['value']['el_svg'] =
50
- field['type'] == Labimotion::FieldType::DRAG_SAMPLE ? el.get_svg_path : File.join('/images', 'molecules', el.molecule_svg_file)
50
+ field['type'] == Labimotion::FieldType::DRAG_SAMPLE ? el.get_svg_path : File.join('/images', 'molecules', el&.molecule_svg_file || 'nosvg')
51
51
  end
52
52
 
53
53
  field_tables = object.properties[Labimotion::Prop::LAYERS][key][Labimotion::Prop::FIELDS].select { |ss| ss['type'] == Labimotion::FieldType::TABLE }
@@ -88,7 +88,7 @@ module Labimotion
88
88
 
89
89
  case obj
90
90
  when Labimotion::Prop::MOLECULE
91
- sub_value[col_id]['value']['el_svg'] = File.join('/images', 'molecules', find_obj.molecule_svg_file)
91
+ sub_value[col_id]['value']['el_svg'] = File.join('/images', 'molecules', find_obj.molecule_svg_file) if find_obj&.molecule_svg_file&.present?
92
92
  sub_value[col_id]['value']['el_inchikey'] = find_obj.inchikey
93
93
  sub_value[col_id]['value']['el_smiles'] = find_obj.cano_smiles
94
94
  sub_value[col_id]['value']['el_iupac'] = find_obj.iupac_name
@@ -20,7 +20,27 @@ module Labimotion
20
20
 
21
21
  object.properties[Labimotion::Prop::LAYERS][key][Labimotion::Prop::FIELDS][idx]['value']['el_label'] = el.short_label if field['type'] == Labimotion::FieldType::DRAG_SAMPLE
22
22
  object.properties[Labimotion::Prop::LAYERS][key][Labimotion::Prop::FIELDS][idx]['value']['el_tip'] = el.short_label if field['type'] == Labimotion::FieldType::DRAG_SAMPLE
23
- object.properties[Labimotion::Prop::LAYERS][key][Labimotion::Prop::FIELDS][idx]['value']['el_svg'] = field['type'] == Labimotion::FieldType::DRAG_SAMPLE ? el.get_svg_path : File.join('/images', 'molecules', el.molecule_svg_file)
23
+ object.properties[Labimotion::Prop::LAYERS][key][Labimotion::Prop::FIELDS][idx]['value']['el_svg'] = field['type'] == Labimotion::FieldType::DRAG_SAMPLE ? el.get_svg_path : File.join('/images', 'molecules', el&.molecule_svg_file || 'nosvg')
24
+ end
25
+
26
+ field_sys_reactions = object.properties[Labimotion::Prop::LAYERS][key][Labimotion::Prop::FIELDS].select { |ss| ss['type'] == Labimotion::FieldType::SYS_REACTION }
27
+ field_sys_reactions.each do |field|
28
+ idx = object.properties[Labimotion::Prop::LAYERS][key][Labimotion::Prop::FIELDS].index(field)
29
+ sid = field.dig('value', 'el_id')
30
+ next unless sid.present?
31
+
32
+ el = Reaction.find_by(id: sid)
33
+ if el.blank?
34
+ object.properties[Labimotion::Prop::LAYERS][key][Labimotion::Prop::FIELDS][idx]['value']['el_tip'] = 'ERROR'
35
+ object.properties[Labimotion::Prop::LAYERS][key][Labimotion::Prop::FIELDS][idx]['value']['el_svg'] = ''
36
+ end
37
+
38
+ next unless el.present?
39
+ next unless object.properties.dig(Labimotion::Prop::LAYERS, key, Labimotion::Prop::FIELDS, idx, 'value').present?
40
+
41
+ object.properties[Labimotion::Prop::LAYERS][key][Labimotion::Prop::FIELDS][idx]['value']['el_label'] = el.short_label
42
+ object.properties[Labimotion::Prop::LAYERS][key][Labimotion::Prop::FIELDS][idx]['value']['el_tip'] = el.short_label
43
+ object.properties[Labimotion::Prop::LAYERS][key][Labimotion::Prop::FIELDS][idx]['value']['el_svg'] = el.reaction_svg_file
24
44
  end
25
45
 
26
46
  field_tables = object.properties[Labimotion::Prop::LAYERS][key][Labimotion::Prop::FIELDS].select { |ss| ss['type'] == Labimotion::FieldType::TABLE }
@@ -49,7 +69,7 @@ module Labimotion
49
69
 
50
70
  case obj
51
71
  when Labimotion::Prop::MOLECULE
52
- sub_value[col_id]['value']['el_svg'] = File.join('/images', 'molecules', find_obj.molecule_svg_file)
72
+ sub_value[col_id]['value']['el_svg'] = File.join('/images', 'molecules', find_obj.molecule_svg_file) if find_obj&.molecule_svg_file&.present?
53
73
  sub_value[col_id]['value']['el_inchikey'] = find_obj.inchikey
54
74
  sub_value[col_id]['value']['el_smiles'] = find_obj.cano_smiles
55
75
  sub_value[col_id]['value']['el_iupac'] = find_obj.iupac_name
@@ -22,7 +22,7 @@ module Labimotion
22
22
 
23
23
  object.properties[Labimotion::Prop::LAYERS][key][Labimotion::Prop::FIELDS][idx]['value']['el_label'] = el.short_label if field['type'] == Labimotion::FieldType::DRAG_SAMPLE
24
24
  object.properties[Labimotion::Prop::LAYERS][key][Labimotion::Prop::FIELDS][idx]['value']['el_tip'] = el.short_label if field['type'] == Labimotion::FieldType::DRAG_SAMPLE
25
- object.properties[Labimotion::Prop::LAYERS][key][Labimotion::Prop::FIELDS][idx]['value']['el_svg'] = field['type'] == Labimotion::FieldType::DRAG_SAMPLE ? el.get_svg_path : File.join('/images', 'molecules', el.molecule_svg_file)
25
+ object.properties[Labimotion::Prop::LAYERS][key][Labimotion::Prop::FIELDS][idx]['value']['el_svg'] = field['type'] == Labimotion::FieldType::DRAG_SAMPLE ? el.get_svg_path : File.join('/images', 'molecules', el&.molecule_svg_file || 'nosvg')
26
26
  end
27
27
 
28
28
  field_tables = object.properties[Labimotion::Prop::LAYERS][key][Labimotion::Prop::FIELDS].select { |ss| ss['type'] == Labimotion::FieldType::TABLE }
@@ -40,7 +40,7 @@ module Labimotion
40
40
  find_mol = Molecule.find_by(id: sub_value[col_id]['value']['el_id'])
41
41
  next unless find_mol.present?
42
42
 
43
- sub_value[col_id]['value']['el_svg'] = File.join('/images', 'molecules', find_mol.molecule_svg_file)
43
+ sub_value[col_id]['value']['el_svg'] = File.join('/images', 'molecules', find_mol.molecule_svg_file) if find_mol&.molecule_svg_file&.present?
44
44
  sub_value[col_id]['value']['el_inchikey'] = find_mol.inchikey
45
45
  sub_value[col_id]['value']['el_smiles'] = find_mol.cano_smiles
46
46
  sub_value[col_id]['value']['el_iupac'] = find_mol.iupac_name
@@ -91,6 +91,20 @@ module Labimotion
91
91
  obj_final = OpenStruct.new(obj_os)
92
92
  field_obj[:structure] = Reporter::Docx::DiagramSample.new(obj: obj_final, format: 'png').generate
93
93
  end
94
+ when Labimotion::FieldType::SYS_REACTION
95
+ val = field.fetch('value', nil)
96
+ if val.present?
97
+ instance = Reaction.find_by(id: val['el_id'])
98
+ field_obj[:value] = val['el_label']
99
+ field_obj[:has_structure] = true
100
+ obj_os = Entities::ReactionReportEntity.new(
101
+ instance,
102
+ current_user: @current_user,
103
+ detail_levels: ElementDetailLevelCalculator.new(user: @current_user, element: instance).detail_levels,
104
+ ).serializable_hash
105
+ obj_final = OpenStruct.new(obj_os)
106
+ field_obj[:structure] = Reporter::Docx::DiagramReaction.new(obj: obj_final, format: 'png').generate
107
+ end
94
108
  when Labimotion::FieldType::DRAG_MOLECULE
95
109
  val = field.fetch('value', nil)
96
110
  if val.present?
@@ -20,6 +20,8 @@ module Labimotion
20
20
  case name
21
21
  when Labimotion::FieldType::DRAG_ELEMENT
22
22
  Labimotion::Prop::L_ELEMENT
23
+ when Labimotion::FieldType::SYS_REACTION
24
+ Labimotion::Prop::REACTION
23
25
  when Labimotion::FieldType::DRAG_SAMPLE
24
26
  Labimotion::Prop::SAMPLE
25
27
  when Labimotion::FieldType::DRAG_MOLECULE
@@ -167,6 +169,7 @@ module Labimotion
167
169
  properties[Labimotion::Prop::LAYERS].keys.each do |key|
168
170
  properties = set_seg_prop(properties, uuids, key, Labimotion::FieldType::DRAG_ELEMENT)
169
171
  properties = set_seg_prop(properties, uuids, key, Labimotion::FieldType::DRAG_SAMPLE)
172
+ properties = set_seg_prop(properties, uuids, key, Labimotion::FieldType::SYS_REACTION)
170
173
  end
171
174
  segment['properties'] = properties
172
175
  segment
@@ -183,6 +186,7 @@ module Labimotion
183
186
  properties = set_prop(properties, uuids, key, Labimotion::FieldType::DRAG_ELEMENT, &fetch_one)
184
187
  properties = set_prop(properties, uuids, key, Labimotion::FieldType::DRAG_MOLECULE, &fetch_one)
185
188
  properties = set_prop(properties, uuids, key, Labimotion::FieldType::DRAG_SAMPLE, &fetch_one)
189
+ properties = set_prop(properties, uuids, key, Labimotion::FieldType::SYS_REACTION, &fetch_one)
186
190
  properties, attachments = set_upload(instance, properties, attachments, uuids, key, Labimotion::FieldType::UPLOAD, &fetch_one)
187
191
  properties = set_table(properties, uuids, key, Labimotion::FieldType::TABLE, &fetch_one)
188
192
  end
@@ -11,13 +11,14 @@ module Labimotion
11
11
  WF_NEXT = 'wf-next'.freeze
12
12
  TEXT_FORMULA = 'text-formula'.freeze
13
13
  SYSTEM_DEFINED = 'system-defined'.freeze
14
+ SYS_REACTION = 'sys-reaction'.freeze
14
15
  DRAG = 'drag'.freeze
15
16
  DRAG_ELEMENT = 'drag_element'.freeze
16
17
  DRAG_MOLECULE = 'drag_molecule'.freeze
17
18
  DRAG_SAMPLE = 'drag_sample'.freeze
18
19
  DRAG_REACTION = 'drag_reaction'.freeze
19
20
  DRAG_MS = [DRAG_MOLECULE, DRAG_SAMPLE].freeze
20
- DRAG_ALL = [DRAG_ELEMENT, DRAG_MOLECULE, DRAG_SAMPLE, DRAG_REACTION].freeze
21
+ DRAG_ALL = [DRAG_ELEMENT, DRAG_MOLECULE, DRAG_SAMPLE, DRAG_REACTION, SYS_REACTION].freeze
21
22
  TABLE = 'table'.freeze
22
23
  UPLOAD = 'upload'.freeze
23
24
  TEXT = 'text'.freeze
@@ -24,7 +24,7 @@ module Labimotion
24
24
  value['el_id'] = molecule.id
25
25
  value['el_tip'] = "#{molecule.inchikey}@@#{molecule.cano_smiles}"
26
26
  value['el_label'] = molecule.iupac_name
27
- value['el_svg'] = File.join('/images', 'molecules', molecule.molecule_svg_file)
27
+ value['el_svg'] = File.join('/images', 'molecules', molecule&.molecule_svg_file) if molecule&.molecule_svg_file.present?
28
28
  value['el_inchikey'] = molecule.inchikey
29
29
  value['el_smiles'] = molecule.cano_smiles
30
30
  value['el_type'] = 'molecule' if value['el_type'].nil?
@@ -51,6 +51,21 @@ module Labimotion
51
51
  value
52
52
  end
53
53
 
54
+ def proc_assign_reaction(value, reaction)
55
+ return {} if reaction.nil?
56
+
57
+ value = {} if value.nil? || value.is_a?(String)
58
+ value['el_id'] = reaction.id
59
+ value['el_type'] = 'reaction' if value['el_type'].nil?
60
+ value['el_tip'] = reaction.short_label
61
+ value['el_label'] = reaction.short_label
62
+ value['el_svg'] = reaction.reaction_svg_file
63
+ value
64
+ rescue StandardError => e
65
+ Labimotion.log_exception(e)
66
+ value
67
+ end
68
+
54
69
  def proc_assign_element(value, element)
55
70
  return {} if element.nil?
56
71
 
@@ -136,6 +151,22 @@ module Labimotion
136
151
  end
137
152
  end
138
153
 
154
+ def self.proc_reaction(layer, key, data, instances, properties)
155
+ fields = layer[Labimotion::Prop::FIELDS].select { |ss| ss['type'] == Labimotion::FieldType::SYS_REACTION }
156
+ fields.each do |field|
157
+ idx = properties[Labimotion::Prop::LAYERS][key][Labimotion::Prop::FIELDS].index(field)
158
+ id = field["value"] && field["value"]["el_id"] unless idx.nil?
159
+ reaction = instances.fetch(Labimotion::Prop::REACTION, nil)&.fetch(id, nil)
160
+ val = properties[Labimotion::Prop::LAYERS][key][Labimotion::Prop::FIELDS][idx]['value']
161
+ val = proc_assign_reaction(val, reaction)
162
+ properties[Labimotion::Prop::LAYERS][key][Labimotion::Prop::FIELDS][idx]['value'] = val
163
+ end
164
+ properties
165
+ rescue StandardError => e
166
+ Labimotion.log_exception(e)
167
+ properties
168
+ end
169
+
139
170
  def self.proc_sample(layer, key, data, instances, properties)
140
171
  fields = layer[Labimotion::Prop::FIELDS].select { |ss| ss['type'] == Labimotion::FieldType::DRAG_SAMPLE }
141
172
  fields.each do |field|
@@ -149,7 +180,7 @@ module Labimotion
149
180
  properties
150
181
  rescue StandardError => e
151
182
  Labimotion.log_exception(e)
152
- raise
183
+ properties
153
184
  end
154
185
 
155
186
  def self.proc_element(layer, key, data, instances, properties, elements)
@@ -169,7 +200,7 @@ module Labimotion
169
200
  properties
170
201
  rescue StandardError => e
171
202
  Labimotion.log_exception(e)
172
- raise
203
+ properties
173
204
  end
174
205
 
175
206
  def self.proc_upload(layer, key, data, instances, attachments, element)
@@ -221,7 +252,7 @@ module Labimotion
221
252
  properties
222
253
  rescue StandardError => e
223
254
  Labimotion.log_exception(e)
224
- raise
255
+ properties
225
256
  end
226
257
 
227
258
 
@@ -237,7 +268,7 @@ module Labimotion
237
268
  properties
238
269
  rescue StandardError => e
239
270
  Labimotion.log_exception(e)
240
- raise
271
+ properties
241
272
  end
242
273
 
243
274
  def self.properties_handler(data, instances, attachments, elmenet, elements)
@@ -246,6 +277,7 @@ module Labimotion
246
277
  layer = properties[Labimotion::Prop::LAYERS][key]
247
278
  properties = proc_molecule(layer, key, data, properties)
248
279
  properties = proc_upload(layer, key, data, instances, attachments, elmenet)
280
+ properties = proc_reaction(layer, key, data, instances, properties)
249
281
  properties = proc_sample(layer, key, data, instances, properties)
250
282
  properties = proc_element(layer, key, data, instances, properties, elements) # unless elements.nil?
251
283
  properties = proc_table(layer, key, data, instances, properties)
@@ -253,7 +285,7 @@ module Labimotion
253
285
  properties
254
286
  rescue StandardError => e
255
287
  Labimotion.log_exception(e)
256
- raise
288
+ properties
257
289
  end
258
290
 
259
291
  def self.process_ai(data, instances)
@@ -272,7 +304,7 @@ module Labimotion
272
304
  end
273
305
  rescue StandardError => e
274
306
  Labimotion.log_exception(e)
275
- raise
307
+ properties
276
308
  end
277
309
 
278
310
  def self.create_segment_klass(sk_obj, segment_klass, element_klass, current_user_id)
@@ -13,7 +13,7 @@ module Labimotion
13
13
 
14
14
  case obj
15
15
  when Labimotion::Prop::MOLECULE
16
- sub_value[col_id]['value']['el_svg'] = File.join('/images', 'molecules', find_obj.molecule_svg_file)
16
+ sub_value[col_id]['value']['el_svg'] = File.join('/images', 'molecules', find_obj.molecule_svg_file) if find_obj&.molecule_svg_file&.present?
17
17
  sub_value[col_id]['value']['el_inchikey'] = find_obj.inchikey
18
18
  sub_value[col_id]['value']['el_smiles'] = find_obj.cano_smiles
19
19
  sub_value[col_id]['value']['el_iupac'] = find_obj.iupac_name
@@ -56,7 +56,7 @@ module Labimotion
56
56
  object.properties[Labimotion::Prop::LAYERS][key][Labimotion::Prop::FIELDS][idx]['value']['el_tip'] = el.short_label if %w[drag_sample].include?(field['type'])
57
57
  object.properties[Labimotion::Prop::LAYERS][key][Labimotion::Prop::FIELDS][idx]['value']['el_tip'] = "#{el.element_klass&.label}@@#{el.name}" if %w[drag_element].include?(field['type'])
58
58
  object.properties[Labimotion::Prop::LAYERS][key][Labimotion::Prop::FIELDS][idx]['value']['icon_name'] = el.element_klass&.icon_name || '' if %w[drag_element].include?(field['type'])
59
- object.properties[Labimotion::Prop::LAYERS][key][Labimotion::Prop::FIELDS][idx]['value']['el_svg'] = field['type'] == Labimotion::FieldType::DRAG_SAMPLE ? el.get_svg_path : File.join('/images', 'molecules', el.molecule_svg_file) if Labimotion::FieldType::DRAG_MS.include?(field['type'])
59
+ object.properties[Labimotion::Prop::LAYERS][key][Labimotion::Prop::FIELDS][idx]['value']['el_svg'] = field['type'] == Labimotion::FieldType::DRAG_SAMPLE ? el.get_svg_path : File.join('/images', 'molecules', el&.molecule_svg_file || 'nosvg') if Labimotion::FieldType::DRAG_MS.include?(field['type'])
60
60
  object.properties[Labimotion::Prop::LAYERS][key][Labimotion::Prop::FIELDS][idx]['value']['el_decoupled'] = el.decoupled if %w[drag_sample].include?(field['type'])
61
61
  end
62
62
 
@@ -2,5 +2,5 @@
2
2
 
3
3
  ## Labimotion Version
4
4
  module Labimotion
5
- VERSION = '1.4.0.rc1'
5
+ VERSION = '1.4.0.rc3'
6
6
  end
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: 1.4.0.rc1
4
+ version: 1.4.0.rc3
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: 2024-05-16 00:00:00.000000000 Z
12
+ date: 2024-06-03 00:00:00.000000000 Z
13
13
  dependencies:
14
14
  - !ruby/object:Gem::Dependency
15
15
  name: rails