opentox-ruby-api-wrapper 1.6.0 → 1.6.1
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- data/Rakefile +2 -1
- data/VERSION +1 -1
- data/lib/algorithm.rb +3 -5
- data/lib/compound.rb +21 -3
- data/lib/dataset.rb +71 -61
- data/lib/environment.rb +4 -72
- data/lib/model.rb +5 -0
- data/lib/opentox-ruby-api-wrapper.rb +1 -1
- data/lib/ot-logger.rb +48 -0
- data/lib/overwrite.rb +14 -0
- data/lib/owl.rb +384 -298
- data/lib/task.rb +6 -6
- data/lib/templates/config.yaml +42 -40
- data/lib/utils.rb +7 -0
- metadata +35 -20
- data/lib/tasks/opentox.rb +0 -107
data/lib/task.rb
CHANGED
@@ -23,9 +23,9 @@ module OpenTox
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|
23
23
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end
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24
24
|
|
25
25
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public
|
26
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-
|
26
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+
def self.find( uri, accept_header='application/rdf+xml' )
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27
27
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task = Task.new(uri)
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28
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-
task.reload
|
28
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+
task.reload( accept_header )
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29
29
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return task
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30
30
|
end
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31
31
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@@ -36,8 +36,8 @@ module OpenTox
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36
36
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return task
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37
37
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end
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38
38
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|
39
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-
def reload
|
40
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-
result = RestClientWrapper.get(uri, {:accept =>
|
39
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+
def reload( accept_header='application/rdf+xml' )
|
40
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+
result = RestClientWrapper.get(uri, {:accept => accept_header}, false)#'application/x-yaml'})
|
41
41
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@http_code = result.code
|
42
42
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reload_from_data(result, result.content_type, uri)
|
43
43
|
end
|
@@ -95,8 +95,8 @@ module OpenTox
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|
95
95
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def wait_for_completion(dur=0.3)
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96
96
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|
97
97
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if (@uri.match(@@config[:services]["opentox-task"]))
|
98
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-
due_to_time = Time.parse(@due_to_time)
|
99
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-
running_time = due_to_time - Time.parse(@date)
|
98
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+
due_to_time = (@due_to_time.is_a?(Time) ? @due_to_time : Time.parse(@due_to_time))
|
99
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+
running_time = due_to_time - (@date.is_a?(Time) ? @date : Time.parse(@date))
|
100
100
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else
|
101
101
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# the date of the external task cannot be trusted, offest to local time might be to big
|
102
102
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due_to_time = Time.new + EXTERNAL_TASK_MAX_DURATION
|
data/lib/templates/config.yaml
CHANGED
@@ -4,12 +4,12 @@
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|
4
4
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#
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5
5
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# Example MySql:
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6
6
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#
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7
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-
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8
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-
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9
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-
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10
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-
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11
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-
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12
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-
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7
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+
:database:
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8
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+
:adapter: mysql
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9
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+
:database: production
|
10
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+
:username: root
|
11
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+
:password: opentox
|
12
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+
:host: localhost
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13
13
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#
|
14
14
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# Example 1: Using external test services
|
15
15
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#
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@@ -22,42 +22,44 @@
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22
22
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# opentox-validation: "http://opentox.informatik.uni-freiburg.de/validation/"
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23
23
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#
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24
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# Example 2: Using local services
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-
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-
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-
|
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-
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-
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30
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-
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31
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-
|
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-
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33
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-
|
25
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+
:base_dir: /home/ist/webservices
|
26
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+
:webserver: passenger
|
27
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+
:services:
|
28
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+
opentox-compound: "http://localhost/compound/"
|
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+
opentox-dataset: "http://localhost/dataset/"
|
30
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+
opentox-algorithm: "http://localhost/algorithm/"
|
31
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+
opentox-model: "http://localhost/model/"
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32
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+
opentox-task: "http://localhost/task/"
|
33
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+
opentox-validation: "http://localhost/validation/"
|
34
34
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#
|
35
35
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# Accept headers:
|
36
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#
|
37
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-
|
38
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-
|
39
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-
|
40
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-
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-
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-
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-
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-
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-
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-
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-
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-
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-
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-
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-
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-
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-
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-
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-
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-
|
57
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-
|
58
|
-
|
37
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+
:accept_headers:
|
38
|
+
opentox-compound:
|
39
|
+
- "chemical/x-daylight-smiles"
|
40
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+
- "chemical/x-inchi"
|
41
|
+
- "chemical/x-mdl-sdfile"
|
42
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+
- "image/gif"
|
43
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+
- "text/plain"
|
44
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+
opentox-dataset:
|
45
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+
- "application/x-yaml"
|
46
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+
- "application/rdf+xml"
|
47
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+
opentox-algorithm:
|
48
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+
- "application/x-yaml"
|
49
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+
- "application/rdf+xml"
|
50
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+
opentox-model:
|
51
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+
- "application/x-yaml"
|
52
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+
- "application/rdf+xml"
|
53
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+
opentox-task:
|
54
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+
- "application/x-yaml"
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55
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+
- "application/rdf+xml"
|
56
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+
opentox-validation:
|
57
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+
- "application/x-yaml"
|
58
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+
- "application/rdf+xml"
|
59
59
|
|
60
60
|
# Timeouts:
|
61
|
-
|
62
|
-
|
63
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-
|
61
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+
:default_task_max_duration: 3600
|
62
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+
:external_task_max_duration: 3600
|
63
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+
|
64
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+
# Uncomment for verbose logging
|
65
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+
# :logger: debug
|
data/lib/utils.rb
CHANGED
metadata
CHANGED
@@ -1,13 +1,13 @@
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1
1
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--- !ruby/object:Gem::Specification
|
2
2
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name: opentox-ruby-api-wrapper
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3
3
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version: !ruby/object:Gem::Version
|
4
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-
hash:
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4
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+
hash: 13
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5
5
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prerelease: false
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6
6
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segments:
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7
7
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- 1
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8
8
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- 6
|
9
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-
-
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10
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-
version: 1.6.
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9
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+
- 1
|
10
|
+
version: 1.6.1
|
11
11
|
platform: ruby
|
12
12
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authors:
|
13
13
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- Christoph Helma, Martin Guetlein
|
@@ -15,7 +15,7 @@ autorequire:
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|
15
15
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bindir: bin
|
16
16
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cert_chain: []
|
17
17
|
|
18
|
-
date: 2010-
|
18
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+
date: 2010-08-09 00:00:00 +02:00
|
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19
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default_executable:
|
20
20
|
dependencies:
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21
21
|
- !ruby/object:Gem::Dependency
|
@@ -243,21 +243,21 @@ dependencies:
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|
243
243
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type: :runtime
|
244
244
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version_requirements: *id016
|
245
245
|
- !ruby/object:Gem::Dependency
|
246
|
-
name:
|
246
|
+
name: rjb
|
247
247
|
prerelease: false
|
248
248
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requirement: &id017 !ruby/object:Gem::Requirement
|
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none: false
|
250
250
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requirements:
|
251
251
|
- - ">="
|
252
252
|
- !ruby/object:Gem::Version
|
253
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-
hash:
|
253
|
+
hash: 3
|
254
254
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segments:
|
255
|
-
-
|
256
|
-
version: "
|
255
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+
- 0
|
256
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+
version: "0"
|
257
257
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type: :runtime
|
258
258
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version_requirements: *id017
|
259
259
|
- !ruby/object:Gem::Dependency
|
260
|
-
name: dm-
|
260
|
+
name: dm-core
|
261
261
|
prerelease: false
|
262
262
|
requirement: &id018 !ruby/object:Gem::Requirement
|
263
263
|
none: false
|
@@ -271,7 +271,7 @@ dependencies:
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|
271
271
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type: :runtime
|
272
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version_requirements: *id018
|
273
273
|
- !ruby/object:Gem::Dependency
|
274
|
-
name: dm-
|
274
|
+
name: dm-serializer
|
275
275
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prerelease: false
|
276
276
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requirement: &id019 !ruby/object:Gem::Requirement
|
277
277
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none: false
|
@@ -285,7 +285,7 @@ dependencies:
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|
285
285
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type: :runtime
|
286
286
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version_requirements: *id019
|
287
287
|
- !ruby/object:Gem::Dependency
|
288
|
-
name: dm-
|
288
|
+
name: dm-timestamps
|
289
289
|
prerelease: false
|
290
290
|
requirement: &id020 !ruby/object:Gem::Requirement
|
291
291
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none: false
|
@@ -299,7 +299,7 @@ dependencies:
|
|
299
299
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type: :runtime
|
300
300
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version_requirements: *id020
|
301
301
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- !ruby/object:Gem::Dependency
|
302
|
-
name: dm-
|
302
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+
name: dm-types
|
303
303
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prerelease: false
|
304
304
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requirement: &id021 !ruby/object:Gem::Requirement
|
305
305
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none: false
|
@@ -313,7 +313,7 @@ dependencies:
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type: :runtime
|
314
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version_requirements: *id021
|
315
315
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- !ruby/object:Gem::Dependency
|
316
|
-
name: dm-
|
316
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+
name: dm-migrations
|
317
317
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prerelease: false
|
318
318
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requirement: &id022 !ruby/object:Gem::Requirement
|
319
319
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none: false
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@@ -327,9 +327,23 @@ dependencies:
|
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327
327
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type: :runtime
|
328
328
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version_requirements: *id022
|
329
329
|
- !ruby/object:Gem::Dependency
|
330
|
-
name:
|
330
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+
name: dm-mysql-adapter
|
331
331
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prerelease: false
|
332
332
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requirement: &id023 !ruby/object:Gem::Requirement
|
333
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+
none: false
|
334
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+
requirements:
|
335
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+
- - ">="
|
336
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+
- !ruby/object:Gem::Version
|
337
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+
hash: 1
|
338
|
+
segments:
|
339
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+
- 1
|
340
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+
version: "1"
|
341
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+
type: :runtime
|
342
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+
version_requirements: *id023
|
343
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+
- !ruby/object:Gem::Dependency
|
344
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+
name: haml
|
345
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+
prerelease: false
|
346
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+
requirement: &id024 !ruby/object:Gem::Requirement
|
333
347
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none: false
|
334
348
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requirements:
|
335
349
|
- - ">="
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@@ -339,11 +353,11 @@ dependencies:
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339
353
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- 3
|
340
354
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version: "3"
|
341
355
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type: :runtime
|
342
|
-
version_requirements: *
|
356
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+
version_requirements: *id024
|
343
357
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- !ruby/object:Gem::Dependency
|
344
358
|
name: cucumber
|
345
359
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prerelease: false
|
346
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-
requirement: &
|
360
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+
requirement: &id025 !ruby/object:Gem::Requirement
|
347
361
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none: false
|
348
362
|
requirements:
|
349
363
|
- - ">="
|
@@ -353,11 +367,11 @@ dependencies:
|
|
353
367
|
- 0
|
354
368
|
version: "0"
|
355
369
|
type: :development
|
356
|
-
version_requirements: *
|
370
|
+
version_requirements: *id025
|
357
371
|
- !ruby/object:Gem::Dependency
|
358
372
|
name: jeweler
|
359
373
|
prerelease: false
|
360
|
-
requirement: &
|
374
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+
requirement: &id026 !ruby/object:Gem::Requirement
|
361
375
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none: false
|
362
376
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requirements:
|
363
377
|
- - ">="
|
@@ -367,7 +381,7 @@ dependencies:
|
|
367
381
|
- 0
|
368
382
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version: "0"
|
369
383
|
type: :development
|
370
|
-
version_requirements: *
|
384
|
+
version_requirements: *id026
|
371
385
|
description: Ruby wrapper for the OpenTox REST API (http://www.opentox.org)
|
372
386
|
email: helma@in-silico.ch
|
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387
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executables:
|
@@ -398,11 +412,12 @@ files:
|
|
398
412
|
- lib/model.rb
|
399
413
|
- lib/opentox-ruby-api-wrapper.rb
|
400
414
|
- lib/opentox.owl
|
415
|
+
- lib/ot-logger.rb
|
416
|
+
- lib/overwrite.rb
|
401
417
|
- lib/owl.rb
|
402
418
|
- lib/rest_client_wrapper.rb
|
403
419
|
- lib/spork.rb
|
404
420
|
- lib/task.rb
|
405
|
-
- lib/tasks/opentox.rb
|
406
421
|
- lib/templates/config.yaml
|
407
422
|
- lib/templates/users.yaml
|
408
423
|
- lib/utils.rb
|
data/lib/tasks/opentox.rb
DELETED
@@ -1,107 +0,0 @@
|
|
1
|
-
require File.join(File.dirname(__FILE__), '..', 'opentox-ruby-api-wrapper.rb')
|
2
|
-
|
3
|
-
namespace :opentox do
|
4
|
-
|
5
|
-
namespace :services do
|
6
|
-
|
7
|
-
desc "Run opentox services"
|
8
|
-
task :start do
|
9
|
-
@@config[:services].each do |service,uri|
|
10
|
-
dir = File.join(@@config[:base_dir], service)
|
11
|
-
server = @@config[:webserver]
|
12
|
-
case server
|
13
|
-
when /thin|mongrel|webrick/
|
14
|
-
port = uri.sub(/^.*:/,'').sub(/\/$/,'')
|
15
|
-
Dir.chdir dir
|
16
|
-
pid_file = File.join(TMP_DIR,"#{service}.pid")
|
17
|
-
begin
|
18
|
-
`#{server} --trace --rackup config.ru start -p #{port} -e #{ENV['RACK_ENV']} -P #{pid_file} -d &`
|
19
|
-
puts "#{service} started on localhost:#{port} in #{ENV['RACK_ENV']} environment with PID file #{pid_file}."
|
20
|
-
rescue
|
21
|
-
puts "Cannot start #{service} on port #{port}."
|
22
|
-
end
|
23
|
-
when 'passenger'
|
24
|
-
FileUtils.mkdir_p File.join(dir, 'tmp')
|
25
|
-
FileUtils.touch File.join(dir, 'tmp/restart.txt')
|
26
|
-
puts "#{service} restarted."
|
27
|
-
else
|
28
|
-
puts "not yet implemented"
|
29
|
-
end
|
30
|
-
end
|
31
|
-
end
|
32
|
-
|
33
|
-
desc "Stop opentox services"
|
34
|
-
task :stop do
|
35
|
-
server = @@config[:webserver]
|
36
|
-
if server =~ /thin|mongrel|webrick/
|
37
|
-
@@config[:services].each do |service,uri|
|
38
|
-
port = uri.sub(/^.*:/,'').sub(/\/$/,'')
|
39
|
-
pid_file = File.join(TMP_DIR,"#{service}.pid")
|
40
|
-
begin
|
41
|
-
puts `#{server} stop -P #{pid_file}`
|
42
|
-
puts "#{service} stopped on localhost:#{port}"
|
43
|
-
rescue
|
44
|
-
puts "Cannot stop #{service} on port #{port}."
|
45
|
-
end
|
46
|
-
end
|
47
|
-
end
|
48
|
-
end
|
49
|
-
|
50
|
-
desc "Restart opentox services"
|
51
|
-
task :restart => [:stop, :start]
|
52
|
-
|
53
|
-
end
|
54
|
-
|
55
|
-
desc "Run all OpenTox tests"
|
56
|
-
task :test do
|
57
|
-
@@config[:services].each do |service,uri|
|
58
|
-
dir = File.join(@@config[:base_dir], service)
|
59
|
-
Dir.chdir dir
|
60
|
-
puts "Running tests in #{dir}"
|
61
|
-
`rake test -t 1>&2`
|
62
|
-
end
|
63
|
-
end
|
64
|
-
|
65
|
-
end
|
66
|
-
|
67
|
-
desc "Start service in current directory"
|
68
|
-
task :start do
|
69
|
-
service = File.basename(Dir.pwd).intern
|
70
|
-
server = @@config[:webserver]
|
71
|
-
case server
|
72
|
-
when /thin|mongrel|webrick/
|
73
|
-
port = @@config[:services][service].sub(/^.*:/,'').sub(/\/$/,'')
|
74
|
-
pid_file = File.join(TMP_DIR,"#{service}.pid")
|
75
|
-
begin
|
76
|
-
`#{server} --trace --rackup config.ru start -p #{port} -e #{ENV['RACK_ENV']} -P #{pid_file} -d &`
|
77
|
-
puts "#{service} started on localhost:#{port} in #{ENV['RACK_ENV']} environment with PID file #{pid_file}."
|
78
|
-
rescue
|
79
|
-
puts "Cannot start #{service} on port #{port}."
|
80
|
-
end
|
81
|
-
when 'passenger'
|
82
|
-
FileUtils.mkdir_p File.join(dir, 'tmp')
|
83
|
-
FileUtils.touch File.join(dir, 'tmp/restart.txt')
|
84
|
-
puts "#{service} restarted."
|
85
|
-
else
|
86
|
-
puts "not yet implemented"
|
87
|
-
end
|
88
|
-
end
|
89
|
-
|
90
|
-
desc "Stop service in current directory"
|
91
|
-
task :stop do
|
92
|
-
service = File.basename(Dir.pwd).intern
|
93
|
-
server = @@config[:webserver]
|
94
|
-
if server =~ /thin|mongrel|webrick/
|
95
|
-
port = @@config[:services][service].sub(/^.*:/,'').sub(/\/$/,'')
|
96
|
-
pid_file = File.join(TMP_DIR,"#{service}.pid")
|
97
|
-
begin
|
98
|
-
puts `thin stop -P #{pid_file}`
|
99
|
-
puts "#{service} stopped on localhost:#{port}"
|
100
|
-
rescue
|
101
|
-
puts "Cannot stop #{service} on port #{port}."
|
102
|
-
end
|
103
|
-
end
|
104
|
-
end
|
105
|
-
|
106
|
-
desc "Restart service in current directory"
|
107
|
-
task :restart => [:stop, :start]
|