isoelectric_point 0.0.4 → 0.0.5
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- data/README.rdoc +3 -3
- metadata +3 -3
data/README.rdoc
CHANGED
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@@ -22,8 +22,8 @@ The available pka sets are:
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22
22
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#what is the protein charge at ph 14?
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23
23
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charge = aa.calculate_charge_at(14)
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24
24
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25
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-
#calculate the ph and round off to
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26
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-
ph = aa.calculate_iep(
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25
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+
#calculate the ph using dtaselect and round off to 3 decimal places
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26
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+
ph = aa.calculate_iep('dtaselect', 3)
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27
27
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# calculate the ph with a custom set
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custom = { "N_TERMINUS" => 8.1,
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@@ -36,4 +36,4 @@ The available pka sets are:
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36
36
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"C" => 8.33,
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37
37
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"Y" => 9.5
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38
38
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}
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39
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-
ph = aa.calculate_iep(
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39
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+
ph = aa.calculate_iep(custom, 3)
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metadata
CHANGED
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@@ -1,13 +1,13 @@
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1
1
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--- !ruby/object:Gem::Specification
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2
2
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name: isoelectric_point
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3
3
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version: !ruby/object:Gem::Version
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4
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-
hash:
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4
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+
hash: 21
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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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- 0
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8
8
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- 0
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9
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-
-
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10
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-
version: 0.0.
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9
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+
- 5
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10
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+
version: 0.0.5
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11
11
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platform: ruby
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12
12
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authors:
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13
13
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- GeorgeG
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