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Test pI (isoelectric point) result

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Thomas Holder
2022-08-08 21:18:30 +02:00
parent ab80128c45
commit 6388e0c4ee
3 changed files with 100 additions and 76 deletions
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49
tests/results/1HPX.dat
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@@ -1,49 +0,0 @@
5.07
3.11
4.62
2.55
9.28
1.78
4.91
2.13
4.78
3.93
3.65
3.89
4.73
3.36
4.07
3.70
2.08
2.11
6.98
7.11
9.41
11.68
9.82
11.61
9.67
9.54
10.43
10.32
11.41
10.54
10.42
10.92
10.55
11.01
11.43
10.47
10.41
11.07
13.96
12.41
14.39
12.35
12.76
12.42
13.73
12.28
8.96
8.96
4.60

55
tests/results/1HPX.json Normal file
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@@ -0,0 +1,55 @@
{
"pI_folded": 9.54,
"pI_unfolded": 8.9,
"pKa": [
5.07,
3.11,
4.62,
2.55,
9.28,
1.78,
4.91,
2.13,
4.78,
3.93,
3.65,
3.89,
4.73,
3.36,
4.07,
3.70,
2.08,
2.11,
6.98,
7.11,
9.41,
11.68,
9.82,
11.61,
9.67,
9.54,
10.43,
10.32,
11.41,
10.54,
10.42,
10.92,
10.55,
11.01,
11.43,
10.47,
10.41,
11.07,
13.96,
12.41,
14.39,
12.35,
12.76,
12.42,
13.73,
12.28,
8.96,
8.96,
4.60
]
}