Nathan Baker
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c2f362a101
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Clean up line endings for vector_algebra.py
See https://github.com/jensengroup/propka-3.1/issues/43
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2020-05-25 20:30:58 -07:00 |
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Nathan Baker
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d965d95fba
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Clean up line breaks in run.py
See https://github.com/jensengroup/propka-3.1/issues/43
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2020-05-25 20:26:18 -07:00 |
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Nathan Baker
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0ac800333d
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Clean up line breaks in protonate.py.
See https://github.com/jensengroup/propka-3.1/issues/43
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2020-05-25 20:25:15 -07:00 |
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Nathan Baker
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a6016ed827
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Clean up line breaks for pdb.py
See https://github.com/jensengroup/propka-3.1/issues/43
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2020-05-25 20:22:28 -07:00 |
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Nathan Baker
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baed55e79a
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Clean up line breaks in parameters.py
See https://github.com/jensengroup/propka-3.1/issues/43
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2020-05-25 20:12:47 -07:00 |
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Nathan Baker
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c796ba6b4d
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Clean up line breaks in output.py
See https://github.com/jensengroup/propka-3.1/issues/43
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2020-05-25 20:00:10 -07:00 |
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Nathan Baker
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a27f054ac7
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Clean up line breaks in molecular_container.py.
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2020-05-25 19:43:32 -07:00 |
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Nathan Baker
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2658f80906
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Clean up line breaks in ligand.py
See https://github.com/jensengroup/propka-3.1/issues/43
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2020-05-25 19:33:07 -07:00 |
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Nathan Baker
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72851b5498
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Clean line breaks.
See https://github.com/jensengroup/propka-3.1/issues/43
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2020-05-25 19:21:56 -07:00 |
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Nathan Baker
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5242366006
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Clean up line breaks in lib.py
See https://github.com/jensengroup/propka-3.1/issues/43
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2020-05-25 19:09:11 -07:00 |
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Nathan Baker
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e5dedc1786
|
De-lint iterative.py
See https://github.com/jensengroup/propka-3.1/issues/43.
|
2020-05-25 18:55:02 -07:00 |
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Nathan Baker
|
919305d8a3
|
Clean up line breaks in group.py and hybrid36.py
https://github.com/jensengroup/propka-3.1/issues/43
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2020-05-25 18:49:51 -07:00 |
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Nathan Baker
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891fecaab3
|
Clean up line breaks in determinants.py
See https://github.com/jensengroup/propka-3.1/issues/43
|
2020-05-25 18:15:46 -07:00 |
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Nathan Baker
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ba8362f514
|
Clean up line breaks in coupled_groups.py
See https://github.com/jensengroup/propka-3.1/issues/43.
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2020-05-25 18:09:59 -07:00 |
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Nathan Baker
|
284a33dfe8
|
Clean up line breaks.
See https://github.com/jensengroup/propka-3.1/issues/43.
|
2020-05-25 17:49:52 -07:00 |
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Nathan Baker
|
1ce44b77bf
|
Clean up line breaks in calculations.py
See https://github.com/jensengroup/propka-3.1/issues/43.
|
2020-05-25 17:33:16 -07:00 |
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Nathan Baker
|
142fa5a004
|
Clean up line breaks in bonds.py.
See https://github.com/jensengroup/propka-3.1/issues/43
|
2020-05-25 17:18:57 -07:00 |
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Nathan Baker
|
4408b23448
|
Clean up line breaks.
For https://github.com/jensengroup/propka-3.1/issues/43
|
2020-05-25 16:42:09 -07:00 |
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Nathan Baker
|
75cdf0ea04
|
De-lint tests.
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2020-05-25 14:44:53 -07:00 |
|
Nathan Baker
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d30705d490
|
De-lint propka31.py.
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2020-05-25 14:38:20 -07:00 |
|
Nathan Baker
|
98263516bc
|
De-lint version.py
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2020-05-25 14:35:02 -07:00 |
|
Nathan Baker
|
2fef500307
|
Restore 3.0 compatibility functions.
|
2020-05-25 14:31:17 -07:00 |
|
Nathan Baker
|
6702f96730
|
De-lint vector_algebra.py
|
2020-05-25 13:53:04 -07:00 |
|
Nathan Baker
|
2321a4df8a
|
De-lint run.py.
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2020-05-25 13:10:55 -07:00 |
|
Nathan Baker
|
cd0e9e5c3d
|
De-lint protonate.py.
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2020-05-25 13:05:16 -07:00 |
|
Nathan Baker
|
b3e2685e94
|
De-lint propka.py.
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2020-05-25 11:54:41 -07:00 |
|
Nathan Baker
|
47226bb4b0
|
Fix deprecated string syntax.
|
2020-05-25 11:29:11 -07:00 |
|
Nathan Baker
|
01385d956f
|
Merge branch 'master' of github.com:jensengroup/propka-3.1
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2020-05-25 10:01:49 -07:00 |
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Nathan Baker
|
0de12f0f3a
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Merge branch 'master' into nathan/delint
|
2020-05-25 10:00:29 -07:00 |
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Nathan Baker
|
a88774c136
|
Have Git ignore Visual Studio code files.
|
2020-05-25 09:59:52 -07:00 |
|
Nathan Baker
|
0164630e2f
|
Remove duplicate propka.cfg file.
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2020-05-25 09:59:20 -07:00 |
|
Nathan Baker
|
32fbb30464
|
De-lint parameters.py.
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2020-05-25 09:58:51 -07:00 |
|
Nathan Baker
|
c7c626791a
|
Remove duplicate propka.cfg.
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2020-05-25 09:55:09 -07:00 |
|
Nathan Baker
|
f38faaed97
|
De-lint output.py.
Public methods/members changed; dependencies checked via Google.
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2020-05-25 08:24:54 -07:00 |
|
Nathan Baker
|
3342d3418c
|
Document need to change Molecular_container name.
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2020-05-25 07:59:55 -07:00 |
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Nathan Baker
|
6190f6d5f5
|
De-lint molecular_container.py.
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2020-05-24 19:47:10 -07:00 |
|
Nathan Baker
|
d8ed3262b9
|
Ignore Visual Studio Code files.
|
2020-05-24 18:32:47 -07:00 |
|
Nathan Baker
|
786a4c9292
|
De-lint ligand.py.
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2020-05-24 18:29:38 -07:00 |
|
Nathan Baker
|
3a5bae5b41
|
De-lint ligand_pka_values.py
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2020-05-24 16:39:59 -07:00 |
|
Nathan Baker
|
59a8717664
|
De-lint lib.py.
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2020-05-24 15:30:35 -07:00 |
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Nathan Baker
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04b52d458c
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De-lint iterative.py.
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2020-05-24 12:05:48 -07:00 |
|
Nathan Baker
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95e132e520
|
De-lint hybrid36.py
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2020-05-24 11:21:55 -07:00 |
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Nathan Baker
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a534d97016
|
De-lint groups.py
I did my best (via Google) to make sure that renamed public members and
methods had minimal impact on others' code.
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2020-05-24 11:13:06 -07:00 |
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Nathan Baker
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6cbcac3be9
|
Make de-linting easier.
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2020-05-24 11:12:47 -07:00 |
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Nathan Baker
|
476ab1f276
|
De-lint determinants.py.
Public methods/members names were changed. These were checked against
Google for potential impact on other packages.
|
2020-05-24 08:53:51 -07:00 |
|
Nathan Baker
|
25648327ce
|
De-lint determinant.py.
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2020-05-24 08:21:05 -07:00 |
|
Nathan Baker
|
c985e02713
|
De-lint coupled_groups.py
Some methods/attributes were changed but were checked in Google to make
sure other codes were not affected.
|
2020-05-23 17:57:12 -07:00 |
|
Nathan Baker
|
83c54ec153
|
De-lint conformation_container.py.
Some public methods/members were changed. These were checked against
Google for obvious use in other packages.
|
2020-05-23 17:22:18 -07:00 |
|
Nathan Baker
|
5afc5d511a
|
Removed missed comment.
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2020-05-23 15:51:47 -07:00 |
|
Nathan Baker
|
5ed77a7cf6
|
De-lint calculations.py.
Changes were made to function names; impacted functions changed in other
files. Google searches performed to look for impacts to other software.
|
2020-05-23 15:02:23 -07:00 |
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