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code coverage test
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clami66 committed Mar 22, 2024
1 parent 0718689 commit 2e298d3
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9 changes: 9 additions & 0 deletions .github/workflows/main.yml
Original file line number Diff line number Diff line change
Expand Up @@ -2,6 +2,10 @@ name: CI

on: [push, pull_request, workflow_dispatch]

env:
MIN_COVERAGE_REQUIRED: 50


jobs:
test:
if: github.event_name != 'pull_request' || github.event.pull_request.head.repo.full_name != github.event.pull_request.base.repo.full_name
Expand All @@ -16,7 +20,11 @@ jobs:
- name: Test pipeline output
run: |
python -m pip install .
python -m pip install coverage
bash ./run_test.sh
- name: Coverage
run: |
test $(coverage report | grep TOTAL | awk '{ print $4 }' | tr -d "%") -ge $MIN_COVERAGE_REQUIRED
test_oldbio:
if: github.event_name != 'pull_request' || github.event.pull_request.head.repo.full_name != github.event.pull_request.base.repo.full_name
Expand All @@ -31,5 +39,6 @@ jobs:
- name: Test pipeline output
run: |
python -m pip install biopython==1.79
python -m pip install coverage
python -m pip install .
bash ./run_test.sh
23 changes: 12 additions & 11 deletions run_test.sh
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Expand Up @@ -2,18 +2,19 @@
set -euo pipefail

# Test that cython version behaves the same as nocython
DockQ examples/1A2K_r_l_b.model.pdb examples/1A2K_r_l_b.pdb
python src/DockQ/DockQ.py examples/1A2K_r_l_b.model.pdb examples/1A2K_r_l_b.pdb
DockQ examples/1A2K_r_l_b.model.pdb examples/1A2K_r_l_b.pdb --no_align
python src/DockQ/DockQ.py examples/1A2K_r_l_b.model.pdb examples/1A2K_r_l_b.pdb --no_align
coverage run -a -m DockQ.DockQ examples/1A2K_r_l_b.model.pdb examples/1A2K_r_l_b.pdb
coverage run -a src/DockQ/DockQ.py examples/1A2K_r_l_b.model.pdb examples/1A2K_r_l_b.pdb
coverage run -a -m DockQ.DockQ examples/1A2K_r_l_b.model.pdb examples/1A2K_r_l_b.pdb --no_align
coverage run -a src/DockQ/DockQ.py examples/1A2K_r_l_b.model.pdb examples/1A2K_r_l_b.pdb --no_align
# Multiple interfaces
DockQ examples/dimer_dimer.model.pdb examples/dimer_dimer.pdb --short
coverage run -a -m DockQ.DockQ examples/dimer_dimer.model.pdb examples/dimer_dimer.pdb --short
# Test on structures with slightly different sequences
DockQ examples/model.pdb examples/native.pdb --allowed_mismatches 1
coverage run -a -m DockQ.DockQ examples/model.pdb examples/native.pdb --allowed_mismatches 1
# Test various mapping strategies
DockQ examples/1EXB_r_l_b.model.pdb examples/1EXB_r_l_b.pdb --short --mapping AB*:BA*
DockQ examples/1EXB_r_l_b.model.pdb examples/1EXB_r_l_b.pdb --short --mapping :ABC
DockQ examples/1EXB_r_l_b.model.pdb examples/1EXB_r_l_b.pdb --short --mapping ABCDEFGH:BADCFEHG
coverage run -a -m DockQ.DockQ examples/1EXB_r_l_b.model.pdb examples/1EXB_r_l_b.pdb --short --mapping AB*:BA*
coverage run -a -m DockQ.DockQ examples/1EXB_r_l_b.model.pdb examples/1EXB_r_l_b.pdb --short --mapping :ABC
coverage run -a -m DockQ.DockQ examples/1EXB_r_l_b.model.pdb examples/1EXB_r_l_b.pdb --short --mapping ABCDEFGH:BADCFEHG
# Test that cif parsing behaves same as pdb parsing
DockQ examples/1EXB_r_l_b.model.pdb examples/1EXB_r_l_b.pdb --mapping DH:AE
DockQ examples/1EXB_r_l_b.model.pdb examples/1EXB.cif.gz
coverage run -a -m DockQ.DockQ examples/1EXB_r_l_b.model.pdb examples/1EXB_r_l_b.pdb --mapping DH:AE
coverage run -a -m DockQ.DockQ examples/1EXB_r_l_b.model.pdb examples/1EXB.cif.gz --mapping DH:AE
coverage report

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