# In next two blocks, deactivate the GbsaObcForceCutoffNonPeriodicTest # and GbsaObcForceCutoffPeriodicTest tests for all systems and then activate for # only the spectrin system. For other systems, the box sizes are too small for the # cutoff required to get reasonable results Block * * Active 0 EndBlock Block #Test CustomTorsionForceTest Test CustomBondForceTest CustomAngleForceTest CustomTorsionForceTest System 1PLXImplicit ala10Implicit 6TNAImplicit ProteinAmberImplicit dnaDickersonImplicit System sv582Implicit bptiImplicit lambdaImplicit lysoImplicit spectrinImplicit System bench0 bench1 bench10 bench101 bench102 bench2 bench3 bench4 bench80 bench81 Active 1 EndBlock Block Test CustomNonbondedForceNoCutoffTest CustomNonbondedForceNonPeriodicCutoffTest CustomNonbondedForcePeriodicCutoffTest System ala10Explicit System ala10Explicit bptiExplicit dnaDickersonExplicit lambdaExplicit lysoExplicit sv582Explicit tna6Explicit water12AExplicit System lambdaExplicit Active 1 EndBlock Block Test CustomGbsaForceNoCutoffTest CustomGbsaForceNonPeriodicCutoffTest CustomGbsaForcePeriodicCutoffTest #Test CustomGbsaForceNonPeriodicCutoffTest CustomGbsaForcePeriodicCutoffTest #System 1PLXImplicit System 1PLXImplicit ala10Implicit 6TNAImplicit ProteinAmberImplicit dnaDickersonImplicit System sv582Implicit bptiImplicit lambdaImplicit lysoImplicit spectrinImplicit System bench0 bench1 bench10 bench101 bench102 bench2 bench3 bench4 bench80 bench81 Active 1 EndBlock Block Test CustomNonbondedForceNoModificationTest #Test CustomGbsaForceNonPeriodicCutoffTest CustomGbsaForcePeriodicCutoffTest System ubiquitinGromacsAmber94NonPeriodic Active 0 EndBlock