coho 0.1

This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.
Files changed (8) hide show
  1. checksums.yaml +7 -0
  2. data/ext/coho/coho.c +75 -0
  3. data/ext/coho/extconf.rb +13 -0
  4. data/ext/coho/src/coho.h +111 -0
  5. data/ext/coho/src/compat.c +91 -0
  6. data/ext/coho/src/smiles.c +2205 -0
  7. data/lib/coho.rb +11 -0
  8. metadata +49 -0
data/lib/coho.rb ADDED
@@ -0,0 +1,11 @@
1
+ module Coho
2
+
3
+ module Smiles
4
+ class Atom
5
+ attr_accessor :atomic_number, :symbol, :isotope, :charge, :hydrogen_count
6
+ attr_accessor :implicit_hydrogen_count
7
+ end
8
+ end
9
+ end
10
+
11
+ require "coho/coho"
metadata ADDED
@@ -0,0 +1,49 @@
1
+ --- !ruby/object:Gem::Specification
2
+ name: coho
3
+ version: !ruby/object:Gem::Version
4
+ version: '0.1'
5
+ platform: ruby
6
+ authors:
7
+ - Ben Cornett
8
+ autorequire:
9
+ bindir: bin
10
+ cert_chain: []
11
+ date: 2019-03-29 00:00:00.000000000 Z
12
+ dependencies: []
13
+ description:
14
+ email:
15
+ executables: []
16
+ extensions:
17
+ - ext/coho/extconf.rb
18
+ extra_rdoc_files: []
19
+ files:
20
+ - ext/coho/coho.c
21
+ - ext/coho/extconf.rb
22
+ - ext/coho/src/coho.h
23
+ - ext/coho/src/compat.c
24
+ - ext/coho/src/smiles.c
25
+ - lib/coho.rb
26
+ homepage:
27
+ licenses:
28
+ - ISC
29
+ metadata: {}
30
+ post_install_message:
31
+ rdoc_options: []
32
+ require_paths:
33
+ - lib
34
+ required_ruby_version: !ruby/object:Gem::Requirement
35
+ requirements:
36
+ - - ">="
37
+ - !ruby/object:Gem::Version
38
+ version: '0'
39
+ required_rubygems_version: !ruby/object:Gem::Requirement
40
+ requirements:
41
+ - - ">="
42
+ - !ruby/object:Gem::Version
43
+ version: '0'
44
+ requirements: []
45
+ rubygems_version: 3.0.3
46
+ signing_key:
47
+ specification_version: 4
48
+ summary: SMILES parser
49
+ test_files: []