mddb 0.0.5 → 0.0.6

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data/config.yml CHANGED
@@ -1,39 +1,23 @@
1
- # Example config
2
- #
3
- # database:
4
- # host: localhost
5
- # port: 12345
6
- # name: 'sim1'
7
- #
8
- #
9
- # If host or port are not defined, localhost and 27017
10
- # MongoDB's default port, will be used.
11
- #
12
- # Only the database name must be strictly defined. It is important
13
- # that you choose a database name that does not already exist, if
14
- # you not want to mess up an older database.
15
-
16
1
  database:
17
- host:
2
+ host:
18
3
  port:
19
- name: 'mddb'
4
+ name: tom_test
20
5
 
21
6
  simulation:
22
- file: 'quick.xyz'
23
- frames: 5
24
- dimensions: 24.8522, 24.8522, 24.8522
25
- count: 1538 # total number of objects per frame
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- objects:
27
- water:
28
- count: 512
29
- start: 1
30
- atom:
31
- - oxygen
32
- - hydrogen
33
- - hydrogen
34
- chain:
35
- count: 1
36
- start: 1537
37
- atom:
38
- - phobe
39
- - phobe
7
+ file: 'quick.xyz'
8
+ dimensions: 24.669, 24.669, 24.669
9
+ count: 1538
10
+ objects:
11
+ water:
12
+ count: 512
13
+ start: 1
14
+ atom:
15
+ - oxygen
16
+ - hydrogen
17
+ - hydrogen
18
+ blob:
19
+ count: 1
20
+ start: 1537
21
+ atom:
22
+ - phobe
23
+ - phobe
data/lib/mddb/config.rb CHANGED
@@ -26,6 +26,9 @@ module Mddb
26
26
  database = Mddb::Config.database['name']
27
27
  MongoMapper.connection = Mongo::Connection.new(host)
28
28
  MongoMapper.database = database
29
+ user = Mddb::Config.database['user']
30
+ pass = Mddb::Config.database['pass']
31
+ MongoMapper.database.authenticate(user,pass)
29
32
  end
30
33
  end
31
34
  end
data/lib/mddb/version.rb CHANGED
@@ -1,3 +1,3 @@
1
1
  module Mddb
2
- VERSION = "0.0.5"
2
+ VERSION = "0.0.6"
3
3
  end
data/lib/mddb.rb CHANGED
@@ -17,7 +17,7 @@ if File.exists? "config.yml"
17
17
  end
18
18
 
19
19
  module Mddb
20
- TEMPLATES = File.expand_path('../mddb/templates', __FILE__)
20
+ TEMPLATES = File.expand_path('mddb/templates', __FILE__)
21
21
 
22
22
  def Mddb.run opts = {}
23
23
  if opts[:all]
data/spec/spec_helper.rb CHANGED
@@ -5,4 +5,8 @@ RSpec.configure do |config|
5
5
  ARGV.push '-v'
6
6
  end
7
7
  end
8
+ $LOAD_PATH.unshift( File.dirname(__FILE__))
9
+ $LOAD_PATH.unshift( File.join(File.dirname(__FILE__), "..","lib") )
8
10
  require 'mddb'
11
+
12
+ puts Mddb::VERSION
metadata CHANGED
@@ -1,7 +1,7 @@
1
1
  --- !ruby/object:Gem::Specification
2
2
  name: mddb
3
3
  version: !ruby/object:Gem::Version
4
- version: 0.0.5
4
+ version: 0.0.6
5
5
  prerelease:
6
6
  platform: ruby
7
7
  authors:
@@ -9,11 +9,11 @@ authors:
9
9
  autorequire:
10
10
  bindir: bin
11
11
  cert_chain: []
12
- date: 2012-02-16 00:00:00.000000000Z
12
+ date: 2012-02-20 00:00:00.000000000Z
13
13
  dependencies:
14
14
  - !ruby/object:Gem::Dependency
15
15
  name: rspec
16
- requirement: &70172418064280 !ruby/object:Gem::Requirement
16
+ requirement: &70093632250640 !ruby/object:Gem::Requirement
17
17
  none: false
18
18
  requirements:
19
19
  - - ! '>='
@@ -21,10 +21,10 @@ dependencies:
21
21
  version: '0'
22
22
  type: :development
23
23
  prerelease: false
24
- version_requirements: *70172418064280
24
+ version_requirements: *70093632250640
25
25
  - !ruby/object:Gem::Dependency
26
26
  name: mongo_mapper
27
- requirement: &70172418063800 !ruby/object:Gem::Requirement
27
+ requirement: &70093632250180 !ruby/object:Gem::Requirement
28
28
  none: false
29
29
  requirements:
30
30
  - - ! '>='
@@ -32,10 +32,10 @@ dependencies:
32
32
  version: '0'
33
33
  type: :runtime
34
34
  prerelease: false
35
- version_requirements: *70172418063800
35
+ version_requirements: *70093632250180
36
36
  - !ruby/object:Gem::Dependency
37
37
  name: hirb
38
- requirement: &70172418063280 !ruby/object:Gem::Requirement
38
+ requirement: &70093632201360 !ruby/object:Gem::Requirement
39
39
  none: false
40
40
  requirements:
41
41
  - - ! '>='
@@ -43,10 +43,10 @@ dependencies:
43
43
  version: '0'
44
44
  type: :runtime
45
45
  prerelease: false
46
- version_requirements: *70172418063280
46
+ version_requirements: *70093632201360
47
47
  - !ruby/object:Gem::Dependency
48
48
  name: thor
49
- requirement: &70172418062800 !ruby/object:Gem::Requirement
49
+ requirement: &70093632200820 !ruby/object:Gem::Requirement
50
50
  none: false
51
51
  requirements:
52
52
  - - ! '>='
@@ -54,10 +54,10 @@ dependencies:
54
54
  version: '0'
55
55
  type: :runtime
56
56
  prerelease: false
57
- version_requirements: *70172418062800
57
+ version_requirements: *70093632200820
58
58
  - !ruby/object:Gem::Dependency
59
59
  name: micro-optparse
60
- requirement: &70172418062380 !ruby/object:Gem::Requirement
60
+ requirement: &70093632200280 !ruby/object:Gem::Requirement
61
61
  none: false
62
62
  requirements:
63
63
  - - ! '>='
@@ -65,7 +65,7 @@ dependencies:
65
65
  version: '0'
66
66
  type: :runtime
67
67
  prerelease: false
68
- version_requirements: *70172418062380
68
+ version_requirements: *70093632200280
69
69
  description: MDDB makes analysing molecular dynamics simulations easy
70
70
  email:
71
71
  - thom.mulvaney@gmail.com