[DNM] Add spectrum workflow#140
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…e into update-documentation
…add-spectrum-improvements
for more information, see https://pre-commit.ci
for more information, see https://pre-commit.ci
for more information, see https://pre-commit.ci
for more information, see https://pre-commit.ci
for more information, see https://pre-commit.ci
…spectrum-workflow # Conflicts: # drugforge-workflows/drugforge/workflows/spectrum_workflows/cli.py
for more information, see https://pre-commit.ci
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Description
Experimental branch for testing some new ideas for spectrum analysis (related to a real task from ASAP on broad spectrum analysis for 2a protease).
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Notable points that this PR has either accomplished or will accomplish.
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Status
Developers certificate of origin