Closed cbaakman closed 3 years ago
Changes Missing Coverage | Covered Lines | Changed/Added Lines | % | ||
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deeprank/parse/top.py | 28 | 29 | 96.55% | ||
deeprank/parse/param.py | 23 | 25 | 92.0% | ||
deeprank/parse/patch.py | 39 | 41 | 95.12% | ||
deeprank/features/ResidueContacts.py | 239 | 251 | 95.22% | ||
<!-- | Total: | 367 | 384 | 95.57% | --> |
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Change from base Build 653736360: | 2.8% |
Covered Lines: | 1995 |
Relevant Lines: | 2495 |
This module should do the same as the AtomicFeature module, except that it computes features for a mutant residue and its surroundings. We will use this in a future implementation of deeprank for the EFRO project.
There's no test done to measure the correctness of the coulomb and vanderwaals energies. I need a tip on how to test this properly.