What is new in the latest version of MacroModel?
Please see the Download Center for the most up-to-date information about what is new in the latest version of MacroModel. New features in MacroModel 9.6 include: • Compressed Maestro files are supported for input and output • Defaults have changed in a number of Maestro panels. • Reduced memory usage on Windows for many types of calculations • More flexibility in naming files is available for serial_split. • Rigid rotor harmonic oscillator calculations (RRHO opcode) now record results as Maestro structure-level properties: rrho heat capacities (r_mmod_rrho_heat_capacities), rrho entropy (r_mmod_rrho_entropy), rrho enthalpy (r_mmod_rrho_enthalpy), and rrho free energy (r_mmod_rrho_free_energy). • MacroModel jobs can be run from the command line with a new interface, $SCHRODINGER/macromodel, and a simplified input file. • An option to turn on or off calculation of constrained-atom mutual interactions has been added to the Potential folder. It sets DEBG 17. • Hydrogen bonds can be fixed d
