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f66f46a7

Commit f66f46a7 authored 10 months ago by Studer Gabriel

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ligand scoring: cleanup

parent c668e953

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modules/mol/alg/pymod/ligand_scoring_base.py 127 additions, 86 deletions

modules/mol/alg/pymod/ligand_scoring_base.py
modules/mol/alg/pymod/ligand_scoring_lddtpli.py 29 additions, 20 deletions

modules/mol/alg/pymod/ligand_scoring_lddtpli.py
modules/mol/alg/pymod/ligand_scoring_scrmsd.py 51 additions, 37 deletions

modules/mol/alg/pymod/ligand_scoring_scrmsd.py

with 207 additions and 143 deletions

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