&PARAMETERS READ_TPGPRM_BIN benz.prmtpg &END &SIMULATION ... &END &INOUT RESTART 50.0 OPEN benz.rst &END &INTEGRATOR ... &END &POTENTIAL .. &END &RUN CONTROL 1 .. &ENDIn this example all topology information and the coordinates of all atoms in the system are taken in care by only three directives: READ_TPGPRM_BIN, RESTART, CONTROL. The files benz.prmtpg and benz.rst which contains the topology and the coordinates, respectively must have been produced with a previous run.
procacci 2021-12-29