simplify code string/fmtlib code some more (960addcc) · Commits · 郑智淋 / lammps

src/reset_mol_ids.cpp

+7 −10

Original line number	Diff line number	Diff line
		@@ -50,10 +50,8 @@ void ResetMolIDs::command(int narg, char **arg)
		int igroup = group->find(arg[0]);
		if (igroup == -1) error->all(FLERR,"Could not find reset_mol_ids group ID");

		if (comm->me == 0) {
		if (screen) fprintf(screen,"Resetting molecule IDs ...\n");
		if (logfile) fprintf(logfile,"Resetting molecule IDs ...\n");
		}
		if (comm->me == 0)
		utils::logmesg(lmp,"Resetting molecule IDs ...\n");

		// record wall time for resetting molecule IDs

		@@ -62,13 +60,12 @@ void ResetMolIDs::command(int narg, char **arg)

		// create instances of compute fragment/atom and compute chunk/atom

		std::string idfrag = "reset_mol_ids_FRAGMENT_ATOM";
		std::string fragcmd = idfrag + fmt::format(" {} fragment/atom",arg[0]);
		modify->add_compute(fragcmd);
		const std::string idfrag = "reset_mol_ids_FRAGMENT_ATOM";
		modify->add_compute(fmt::format("{} {} fragment/atom",idfrag, arg[0]));

		std::string idchunk = "reset_mol_ids_CHUNK_ATOM";
		std::string chunkcmd = idchunk + fmt::format(" all chunk/atom molecule compress yes");
		modify->add_compute(chunkcmd);
		const std::string idchunk = "reset_mol_ids_CHUNK_ATOM";
		modify->add_compute(fmt::format("{} all chunk/atom molecule compress yes",
		idchunk));

		// initialize system since comm->borders() will be invoked