CREST3.0.3 native mergebias+ automaticallycontinues toMDOPT of3C7H16targets. Fixed9referenceGFN2/GFNFFdifferencepotentialfrompreviousdataset,notDFT. Targets expanded1%geometricallyaboutcentroid,energycommentsblankbecausecoordinateschanged;notpressureexperiment. LegacyexternalxTB6.7.1actuallyappliesbias.28independentchecks nativeenergy andKabschGaussianRMSDconvertedAtoBohr. Existingpotentialbyteidenticalafterduplicate-input merge. Originalalready-converged-inputcontrol scopedonlymotiondemonstration retained. read/plotreferenceonly;submitnewcalculationexplicitly. PrivateCRESTbuild only no sharedchanges.
