Update ABFE setup notebook to include multiple distance restraints#14
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jmichel80 merged 1 commit intoOpenBioSim:mainfrom Dec 6, 2023
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This requires the changes to BioSimSpace implemented here: OpenBioSim/biosimspace#178.
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This updates the ABFE setup notebook with examples showing how to use multiple distance restraints with SOMD or GROMACS. The required changes to BioSimSpace are implemented in this PR: OpenBioSim/biosimspace#178.