MacroModel Reference Manual - ISP

Chapter 4: Operation Codes4.15 Miscellaneous Commands and DebuggingDEBG — DEBuGgingTurn on program debug switch (numbered 1-1100). Use as many of these commands as necessaryto turn on as many of the switches as you want.arg1-4Debug switchesValues currently in use are listed below. “GV” stands for “Greater Verbosity.” Flagsdescribed with this abbreviation affect only the level of reporting; other flags affectprogram action.1 GV, all commands2 Don’t line-buffer .log file3 Always write full (never compressed) output files5 GV, dynamic allocation6 Always write old-style (mmio) files7 Always write new-style (m2io) files8 GV, correspondence between mainCT and sbstrCT numbering9 GV, handling of mmio/m2io files10 GV, RWND command11 Get formal charge from .fld instead of atom.typ12 Don’t set qq product to zero, VDWB nonbondeds13 GV, LIGB, and VDWB bonds14 GV, SUBS, FXAT, FXDI, FXBA, FXTA command handlers15 GV, reading charges from ffld substructures16 GV, VDW offset from ffld17 Suppress elimination of constrained-atom mutual interactions18 GV, charge delocalizationMacroModel 9.7 Reference Manual 141