in.read_data-007
e6ac7757a374efficient_neuronet

in.read_data-007
View Options

			timer off

			atom_style full

			# set up dummy styles to be able to read data file and skip force field data.
			pair_style zero 5.0 nocoeff
			bond_style zero nocoeff
			angle_style zero nocoeff
			dihedral_style zero nocoeff
			improper_style zero nocoeff

			read_data peptide.data

			# apply an offset of 3 to all molecule ids
			variable mid atom mol+3
			set group all mol v_mid

			info all

			# turn off all styles, so we get a clean data file
			pair_style none
			bond_style none
			angle_style none
			dihedral_style none
			improper_style none
			write_data new.data noinit