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b95e8095

Commit b95e8095 authored 7 years ago by Rafal Gumienny

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fix: SCHWED-3120 Move lDDT calculations to OligolDDTScorer

parent 1c15d14e

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Changes 5

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actions/ost-compare-structures 14 additions, 29 deletions

actions/ost-compare-structures
modules/mol/alg/pymod/qsscoring.py 65 additions, 10 deletions

modules/mol/alg/pymod/qsscoring.py
modules/mol/alg/pymod/wrap_mol_alg.cc 12 additions, 0 deletions

modules/mol/alg/pymod/wrap_mol_alg.cc
modules/mol/alg/src/local_dist_diff_test.cc 4 additions, 0 deletions

modules/mol/alg/src/local_dist_diff_test.cc
modules/mol/alg/src/local_dist_diff_test.hh 1 addition, 0 deletions

modules/mol/alg/src/local_dist_diff_test.hh

with 96 additions and 39 deletions

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