Open WardLT opened 8 months ago
Changes Missing Coverage | Covered Lines | Changed/Added Lines | % | ||
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mofa/utils/difflinker_sample_and_analyze.py | 12 | 13 | 92.31% | ||
<!-- | Total: | 25 | 26 | 96.15% | --> |
Files with Coverage Reduction | New Missed Lines | % | ||
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mofa/utils/src/edm.py | 26 | 58.46% | ||
<!-- | Total: | 26 | --> |
Totals | |
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Change from base Build 8457625987: | 0.2% |
Covered Lines: | 4141 |
Relevant Lines: | 9900 |
Vary the length of molecule during generation and infer the number of atoms required to fill it using @hyunp2 's GNN
The user can also provide a range of how much to vary the distance between anchors before generating a molecule