CPPTRAJ: Trajectory Analysis. V16.00b OpenMP ___ ___ ___ ___ | \/ | \/ | \/ | _|_/\_|_/\_|_/\_|_ | Date/time: 02/05/16 11:01:48 | Available memory: 1.428 GB INPUT: Reading input from 'pt-clust.in' [parm ../../tip3p/ff12sb/run1/build/full.topo.hmr [tip3p-ff12sb]] Reading '../../tip3p/ff12sb/run1/build/full.topo.hmr' as Amber Topology [parm ../../tip3p/dacP-ff12sb/run1/build/full.topo.hmr [tip3p-dacP-ff12sb]] Reading '../../tip3p/dacP-ff12sb/run1/build/full.topo.hmr' as Amber Topology [parm ../../tip3p/chen-garcia/run1/build/full.topo.hmr [tip3p-chen-garcia]] Reading '../../tip3p/chen-garcia/run1/build/full.topo.hmr' as Amber Topology [parm ../../tip3p/charmm36/run1/build/full.topo.hmr [tip3p-charmm36]] Reading '../../tip3p/charmm36/run1/build/full.topo.hmr' as Amber Topology CHAMBER topology: 1: CHARMM 361 * \\\\ CHARMM36 All-Hydrogen Nucleic Acid Topology File /// [parm ../../opc/ff12sb/run1/build/full.topo.hmr [opc-ff12sb]] Reading '../../opc/ff12sb/run1/build/full.topo.hmr' as Amber Topology [parm ../../opc/dacP-ff12sb/run1/build/full.topo.hmr [opc-dacP-ff12sb]] Reading '../../opc/dacP-ff12sb/run1/build/full.topo.hmr' as Amber Topology [trajin ../../tip3p/ff12sb/run1/traj.1.01 remdtraj remdtrajtemp 298.41 trajnames ../../tip3p/ff12sb/run1/traj.1.02,../../tip3p/ff12sb/run1/traj.1.03,../../tip3p/ff12sb/run1/traj.1.04,../../tip3p/ff12sb/run1/traj.1.05,../../tip3p/ff12sb/run1/traj.1.06,../../tip3p/ff12sb/run1/traj.1.07,../../tip3p/ff12sb/run1/traj.1.08,../../tip3p/ff12sb/run1/traj.1.09,../../tip3p/ff12sb/run1/traj.1.10,../../tip3p/ff12sb/run1/traj.1.11,../../tip3p/ff12sb/run1/traj.1.12,../../tip3p/ff12sb/run1/traj.1.13,../../tip3p/ff12sb/run1/traj.1.14,../../tip3p/ff12sb/run1/traj.1.15,../../tip3p/ff12sb/run1/traj.1.16,../../tip3p/ff12sb/run1/traj.1.17,../../tip3p/ff12sb/run1/traj.1.18 parm [tip3p-ff12sb]] Reading '../../tip3p/ff12sb/run1/traj.1.01' as Amber NetCDF Reading '../../tip3p/ff12sb/run1/traj.1.02' as Amber NetCDF Reading '../../tip3p/ff12sb/run1/traj.1.03' as Amber NetCDF Reading '../../tip3p/ff12sb/run1/traj.1.04' as Amber NetCDF Reading '../../tip3p/ff12sb/run1/traj.1.05' as Amber NetCDF Reading '../../tip3p/ff12sb/run1/traj.1.06' as Amber NetCDF Reading '../../tip3p/ff12sb/run1/traj.1.07' as Amber NetCDF Reading '../../tip3p/ff12sb/run1/traj.1.08' as Amber NetCDF Reading '../../tip3p/ff12sb/run1/traj.1.09' as Amber NetCDF Reading '../../tip3p/ff12sb/run1/traj.1.10' as Amber NetCDF Reading '../../tip3p/ff12sb/run1/traj.1.11' as Amber NetCDF Reading '../../tip3p/ff12sb/run1/traj.1.12' as Amber NetCDF Reading '../../tip3p/ff12sb/run1/traj.1.13' as Amber NetCDF Reading '../../tip3p/ff12sb/run1/traj.1.14' as Amber NetCDF Reading '../../tip3p/ff12sb/run1/traj.1.15' as Amber NetCDF Reading '../../tip3p/ff12sb/run1/traj.1.16' as Amber NetCDF Reading '../../tip3p/ff12sb/run1/traj.1.17' as Amber NetCDF Reading '../../tip3p/ff12sb/run1/traj.1.18' as Amber NetCDF [trajin ../../tip3p/ff12sb/run2/traj.1.01 remdtraj remdtrajtemp 298.41 trajnames ../../tip3p/ff12sb/run2/traj.1.02,../../tip3p/ff12sb/run2/traj.1.03,../../tip3p/ff12sb/run2/traj.1.04,../../tip3p/ff12sb/run2/traj.1.05,../../tip3p/ff12sb/run2/traj.1.06,../../tip3p/ff12sb/run2/traj.1.07,../../tip3p/ff12sb/run2/traj.1.08,../../tip3p/ff12sb/run2/traj.1.09,../../tip3p/ff12sb/run2/traj.1.10,../../tip3p/ff12sb/run2/traj.1.11,../../tip3p/ff12sb/run2/traj.1.12,../../tip3p/ff12sb/run2/traj.1.13,../../tip3p/ff12sb/run2/traj.1.14,../../tip3p/ff12sb/run2/traj.1.15,../../tip3p/ff12sb/run2/traj.1.16,../../tip3p/ff12sb/run2/traj.1.17,../../tip3p/ff12sb/run2/traj.1.18 parm [tip3p-ff12sb]] Reading '../../tip3p/ff12sb/run2/traj.1.01' as Amber NetCDF Reading '../../tip3p/ff12sb/run2/traj.1.02' as Amber NetCDF Reading '../../tip3p/ff12sb/run2/traj.1.03' as Amber NetCDF Reading '../../tip3p/ff12sb/run2/traj.1.04' as Amber NetCDF Reading '../../tip3p/ff12sb/run2/traj.1.05' as Amber NetCDF Reading '../../tip3p/ff12sb/run2/traj.1.06' as Amber NetCDF Reading '../../tip3p/ff12sb/run2/traj.1.07' as Amber NetCDF Reading '../../tip3p/ff12sb/run2/traj.1.08' as Amber NetCDF Reading '../../tip3p/ff12sb/run2/traj.1.09' as Amber NetCDF Reading '../../tip3p/ff12sb/run2/traj.1.10' as Amber NetCDF Reading '../../tip3p/ff12sb/run2/traj.1.11' as Amber NetCDF Reading '../../tip3p/ff12sb/run2/traj.1.12' as Amber NetCDF Reading '../../tip3p/ff12sb/run2/traj.1.13' as Amber NetCDF Reading '../../tip3p/ff12sb/run2/traj.1.14' as Amber NetCDF Reading '../../tip3p/ff12sb/run2/traj.1.15' as Amber NetCDF Reading '../../tip3p/ff12sb/run2/traj.1.16' as Amber NetCDF Reading '../../tip3p/ff12sb/run2/traj.1.17' as Amber NetCDF Reading '../../tip3p/ff12sb/run2/traj.1.18' as Amber NetCDF [trajin ../../tip3p/dacP-ff12sb/run1/traj.1.01 remdtraj remdtrajtemp 298.41 trajnames ../../tip3p/dacP-ff12sb/run1/traj.1.02,../../tip3p/dacP-ff12sb/run1/traj.1.03,../../tip3p/dacP-ff12sb/run1/traj.1.04,../../tip3p/dacP-ff12sb/run1/traj.1.05,../../tip3p/dacP-ff12sb/run1/traj.1.06,../../tip3p/dacP-ff12sb/run1/traj.1.07,../../tip3p/dacP-ff12sb/run1/traj.1.08,../../tip3p/dacP-ff12sb/run1/traj.1.09,../../tip3p/dacP-ff12sb/run1/traj.1.10,../../tip3p/dacP-ff12sb/run1/traj.1.11,../../tip3p/dacP-ff12sb/run1/traj.1.12,../../tip3p/dacP-ff12sb/run1/traj.1.13,../../tip3p/dacP-ff12sb/run1/traj.1.14,../../tip3p/dacP-ff12sb/run1/traj.1.15,../../tip3p/dacP-ff12sb/run1/traj.1.16,../../tip3p/dacP-ff12sb/run1/traj.1.17,../../tip3p/dacP-ff12sb/run1/traj.1.18 parm [tip3p-dacP-ff12sb]] Reading '../../tip3p/dacP-ff12sb/run1/traj.1.01' as Amber NetCDF Reading '../../tip3p/dacP-ff12sb/run1/traj.1.02' as Amber NetCDF Reading '../../tip3p/dacP-ff12sb/run1/traj.1.03' as Amber NetCDF Reading '../../tip3p/dacP-ff12sb/run1/traj.1.04' as Amber NetCDF Reading '../../tip3p/dacP-ff12sb/run1/traj.1.05' as Amber NetCDF Reading '../../tip3p/dacP-ff12sb/run1/traj.1.06' as Amber NetCDF Reading '../../tip3p/dacP-ff12sb/run1/traj.1.07' as Amber NetCDF Reading '../../tip3p/dacP-ff12sb/run1/traj.1.08' as Amber NetCDF Reading '../../tip3p/dacP-ff12sb/run1/traj.1.09' as Amber NetCDF Reading '../../tip3p/dacP-ff12sb/run1/traj.1.10' as Amber NetCDF Reading '../../tip3p/dacP-ff12sb/run1/traj.1.11' as Amber NetCDF Reading '../../tip3p/dacP-ff12sb/run1/traj.1.12' as Amber NetCDF Reading '../../tip3p/dacP-ff12sb/run1/traj.1.13' as Amber NetCDF Reading '../../tip3p/dacP-ff12sb/run1/traj.1.14' as Amber NetCDF Reading '../../tip3p/dacP-ff12sb/run1/traj.1.15' as Amber NetCDF Reading '../../tip3p/dacP-ff12sb/run1/traj.1.16' as Amber NetCDF Reading '../../tip3p/dacP-ff12sb/run1/traj.1.17' as Amber NetCDF Reading '../../tip3p/dacP-ff12sb/run1/traj.1.18' as Amber NetCDF [trajin ../../tip3p/dacP-ff12sb/run2/traj.1.01 remdtraj remdtrajtemp 298.41 trajnames ../../tip3p/dacP-ff12sb/run2/traj.1.02,../../tip3p/dacP-ff12sb/run2/traj.1.03,../../tip3p/dacP-ff12sb/run2/traj.1.04,../../tip3p/dacP-ff12sb/run2/traj.1.05,../../tip3p/dacP-ff12sb/run2/traj.1.06,../../tip3p/dacP-ff12sb/run2/traj.1.07,../../tip3p/dacP-ff12sb/run2/traj.1.08,../../tip3p/dacP-ff12sb/run2/traj.1.09,../../tip3p/dacP-ff12sb/run2/traj.1.10,../../tip3p/dacP-ff12sb/run2/traj.1.11,../../tip3p/dacP-ff12sb/run2/traj.1.12,../../tip3p/dacP-ff12sb/run2/traj.1.13,../../tip3p/dacP-ff12sb/run2/traj.1.14,../../tip3p/dacP-ff12sb/run2/traj.1.15,../../tip3p/dacP-ff12sb/run2/traj.1.16,../../tip3p/dacP-ff12sb/run2/traj.1.17,../../tip3p/dacP-ff12sb/run2/traj.1.18 parm [tip3p-dacP-ff12sb]] Reading '../../tip3p/dacP-ff12sb/run2/traj.1.01' as Amber NetCDF Reading '../../tip3p/dacP-ff12sb/run2/traj.1.02' as Amber NetCDF Reading '../../tip3p/dacP-ff12sb/run2/traj.1.03' as Amber NetCDF Reading '../../tip3p/dacP-ff12sb/run2/traj.1.04' as Amber NetCDF Reading '../../tip3p/dacP-ff12sb/run2/traj.1.05' as Amber NetCDF Reading '../../tip3p/dacP-ff12sb/run2/traj.1.06' as Amber NetCDF Reading '../../tip3p/dacP-ff12sb/run2/traj.1.07' as Amber NetCDF Reading '../../tip3p/dacP-ff12sb/run2/traj.1.08' as Amber NetCDF Reading '../../tip3p/dacP-ff12sb/run2/traj.1.09' as Amber NetCDF Reading '../../tip3p/dacP-ff12sb/run2/traj.1.10' as Amber NetCDF Reading '../../tip3p/dacP-ff12sb/run2/traj.1.11' as Amber NetCDF Reading '../../tip3p/dacP-ff12sb/run2/traj.1.12' as Amber NetCDF Reading '../../tip3p/dacP-ff12sb/run2/traj.1.13' as Amber NetCDF Reading '../../tip3p/dacP-ff12sb/run2/traj.1.14' as Amber NetCDF Reading '../../tip3p/dacP-ff12sb/run2/traj.1.15' as Amber NetCDF Reading '../../tip3p/dacP-ff12sb/run2/traj.1.16' as Amber NetCDF Reading '../../tip3p/dacP-ff12sb/run2/traj.1.17' as Amber NetCDF Reading '../../tip3p/dacP-ff12sb/run2/traj.1.18' as Amber NetCDF [trajin ../../tip3p/chen-garcia/run1/traj.1.01 remdtraj remdtrajtemp 298.41 trajnames ../../tip3p/chen-garcia/run1/traj.1.02,../../tip3p/chen-garcia/run1/traj.1.03,../../tip3p/chen-garcia/run1/traj.1.04,../../tip3p/chen-garcia/run1/traj.1.05,../../tip3p/chen-garcia/run1/traj.1.06,../../tip3p/chen-garcia/run1/traj.1.07,../../tip3p/chen-garcia/run1/traj.1.08,../../tip3p/chen-garcia/run1/traj.1.09,../../tip3p/chen-garcia/run1/traj.1.10,../../tip3p/chen-garcia/run1/traj.1.11,../../tip3p/chen-garcia/run1/traj.1.12,../../tip3p/chen-garcia/run1/traj.1.13,../../tip3p/chen-garcia/run1/traj.1.14,../../tip3p/chen-garcia/run1/traj.1.15,../../tip3p/chen-garcia/run1/traj.1.16,../../tip3p/chen-garcia/run1/traj.1.17,../../tip3p/chen-garcia/run1/traj.1.18 parm [tip3p-chen-garcia]] Reading '../../tip3p/chen-garcia/run1/traj.1.01' as Amber NetCDF Reading '../../tip3p/chen-garcia/run1/traj.1.02' as Amber NetCDF Reading '../../tip3p/chen-garcia/run1/traj.1.03' as Amber NetCDF Reading '../../tip3p/chen-garcia/run1/traj.1.04' as Amber NetCDF Reading '../../tip3p/chen-garcia/run1/traj.1.05' as Amber NetCDF Reading '../../tip3p/chen-garcia/run1/traj.1.06' as Amber NetCDF Reading '../../tip3p/chen-garcia/run1/traj.1.07' as Amber NetCDF Reading '../../tip3p/chen-garcia/run1/traj.1.08' as Amber NetCDF Reading '../../tip3p/chen-garcia/run1/traj.1.09' as Amber NetCDF Reading '../../tip3p/chen-garcia/run1/traj.1.10' as Amber NetCDF Reading '../../tip3p/chen-garcia/run1/traj.1.11' as Amber NetCDF Reading '../../tip3p/chen-garcia/run1/traj.1.12' as Amber NetCDF Reading '../../tip3p/chen-garcia/run1/traj.1.13' as Amber NetCDF Reading '../../tip3p/chen-garcia/run1/traj.1.14' as Amber NetCDF Reading '../../tip3p/chen-garcia/run1/traj.1.15' as Amber NetCDF Reading '../../tip3p/chen-garcia/run1/traj.1.16' as Amber NetCDF Reading '../../tip3p/chen-garcia/run1/traj.1.17' as Amber NetCDF Reading '../../tip3p/chen-garcia/run1/traj.1.18' as Amber NetCDF [trajin ../../tip3p/chen-garcia/run2/traj.1.01 remdtraj remdtrajtemp 298.41 trajnames ../../tip3p/chen-garcia/run2/traj.1.02,../../tip3p/chen-garcia/run2/traj.1.03,../../tip3p/chen-garcia/run2/traj.1.04,../../tip3p/chen-garcia/run2/traj.1.05,../../tip3p/chen-garcia/run2/traj.1.06,../../tip3p/chen-garcia/run2/traj.1.07,../../tip3p/chen-garcia/run2/traj.1.08,../../tip3p/chen-garcia/run2/traj.1.09,../../tip3p/chen-garcia/run2/traj.1.10,../../tip3p/chen-garcia/run2/traj.1.11,../../tip3p/chen-garcia/run2/traj.1.12,../../tip3p/chen-garcia/run2/traj.1.13,../../tip3p/chen-garcia/run2/traj.1.14,../../tip3p/chen-garcia/run2/traj.1.15,../../tip3p/chen-garcia/run2/traj.1.16,../../tip3p/chen-garcia/run2/traj.1.17,../../tip3p/chen-garcia/run2/traj.1.18 parm [tip3p-chen-garcia]] Reading '../../tip3p/chen-garcia/run2/traj.1.01' as Amber NetCDF Reading '../../tip3p/chen-garcia/run2/traj.1.02' as Amber NetCDF Reading '../../tip3p/chen-garcia/run2/traj.1.03' as Amber NetCDF Reading '../../tip3p/chen-garcia/run2/traj.1.04' as Amber NetCDF Reading '../../tip3p/chen-garcia/run2/traj.1.05' as Amber NetCDF Reading '../../tip3p/chen-garcia/run2/traj.1.06' as Amber NetCDF Reading '../../tip3p/chen-garcia/run2/traj.1.07' as Amber NetCDF Reading '../../tip3p/chen-garcia/run2/traj.1.08' as Amber NetCDF Reading '../../tip3p/chen-garcia/run2/traj.1.09' as Amber NetCDF Reading '../../tip3p/chen-garcia/run2/traj.1.10' as Amber NetCDF Reading '../../tip3p/chen-garcia/run2/traj.1.11' as Amber NetCDF Reading '../../tip3p/chen-garcia/run2/traj.1.12' as Amber NetCDF Reading '../../tip3p/chen-garcia/run2/traj.1.13' as Amber NetCDF Reading '../../tip3p/chen-garcia/run2/traj.1.14' as Amber NetCDF Reading '../../tip3p/chen-garcia/run2/traj.1.15' as Amber NetCDF Reading '../../tip3p/chen-garcia/run2/traj.1.16' as Amber NetCDF Reading '../../tip3p/chen-garcia/run2/traj.1.17' as Amber NetCDF Reading '../../tip3p/chen-garcia/run2/traj.1.18' as Amber NetCDF [trajin ../../tip3p/charmm36/run1/traj.1.01 remdtraj remdtrajtemp 298.41 trajnames ../../tip3p/charmm36/run1/traj.1.02,../../tip3p/charmm36/run1/traj.1.03,../../tip3p/charmm36/run1/traj.1.04,../../tip3p/charmm36/run1/traj.1.05,../../tip3p/charmm36/run1/traj.1.06,../../tip3p/charmm36/run1/traj.1.07,../../tip3p/charmm36/run1/traj.1.08,../../tip3p/charmm36/run1/traj.1.09,../../tip3p/charmm36/run1/traj.1.10,../../tip3p/charmm36/run1/traj.1.11,../../tip3p/charmm36/run1/traj.1.12,../../tip3p/charmm36/run1/traj.1.13,../../tip3p/charmm36/run1/traj.1.14,../../tip3p/charmm36/run1/traj.1.15,../../tip3p/charmm36/run1/traj.1.16,../../tip3p/charmm36/run1/traj.1.17,../../tip3p/charmm36/run1/traj.1.18 parm [tip3p-charmm36]] Reading '../../tip3p/charmm36/run1/traj.1.01' as Amber NetCDF Reading '../../tip3p/charmm36/run1/traj.1.02' as Amber NetCDF Reading '../../tip3p/charmm36/run1/traj.1.03' as Amber NetCDF Reading '../../tip3p/charmm36/run1/traj.1.04' as Amber NetCDF Reading '../../tip3p/charmm36/run1/traj.1.05' as Amber NetCDF Reading '../../tip3p/charmm36/run1/traj.1.06' as Amber NetCDF Reading '../../tip3p/charmm36/run1/traj.1.07' as Amber NetCDF Reading '../../tip3p/charmm36/run1/traj.1.08' as Amber NetCDF Reading '../../tip3p/charmm36/run1/traj.1.09' as Amber NetCDF Reading '../../tip3p/charmm36/run1/traj.1.10' as Amber NetCDF Reading '../../tip3p/charmm36/run1/traj.1.11' as Amber NetCDF Reading '../../tip3p/charmm36/run1/traj.1.12' as Amber NetCDF Reading '../../tip3p/charmm36/run1/traj.1.13' as Amber NetCDF Reading '../../tip3p/charmm36/run1/traj.1.14' as Amber NetCDF Reading '../../tip3p/charmm36/run1/traj.1.15' as Amber NetCDF Reading '../../tip3p/charmm36/run1/traj.1.16' as Amber NetCDF Reading '../../tip3p/charmm36/run1/traj.1.17' as Amber NetCDF Reading '../../tip3p/charmm36/run1/traj.1.18' as Amber NetCDF [trajin ../../tip3p/charmm36/run2/traj.1.01 remdtraj remdtrajtemp 298.41 trajnames ../../tip3p/charmm36/run2/traj.1.02,../../tip3p/charmm36/run2/traj.1.03,../../tip3p/charmm36/run2/traj.1.04,../../tip3p/charmm36/run2/traj.1.05,../../tip3p/charmm36/run2/traj.1.06,../../tip3p/charmm36/run2/traj.1.07,../../tip3p/charmm36/run2/traj.1.08,../../tip3p/charmm36/run2/traj.1.09,../../tip3p/charmm36/run2/traj.1.10,../../tip3p/charmm36/run2/traj.1.11,../../tip3p/charmm36/run2/traj.1.12,../../tip3p/charmm36/run2/traj.1.13,../../tip3p/charmm36/run2/traj.1.14,../../tip3p/charmm36/run2/traj.1.15,../../tip3p/charmm36/run2/traj.1.16,../../tip3p/charmm36/run2/traj.1.17,../../tip3p/charmm36/run2/traj.1.18 parm [tip3p-charmm36]] Reading '../../tip3p/charmm36/run2/traj.1.01' as Amber NetCDF Reading '../../tip3p/charmm36/run2/traj.1.02' as Amber NetCDF Reading '../../tip3p/charmm36/run2/traj.1.03' as Amber NetCDF Reading '../../tip3p/charmm36/run2/traj.1.04' as Amber NetCDF Reading '../../tip3p/charmm36/run2/traj.1.05' as Amber NetCDF Reading '../../tip3p/charmm36/run2/traj.1.06' as Amber NetCDF Reading '../../tip3p/charmm36/run2/traj.1.07' as Amber NetCDF Reading '../../tip3p/charmm36/run2/traj.1.08' as Amber NetCDF Reading '../../tip3p/charmm36/run2/traj.1.09' as Amber NetCDF Reading '../../tip3p/charmm36/run2/traj.1.10' as Amber NetCDF Reading '../../tip3p/charmm36/run2/traj.1.11' as Amber NetCDF Reading '../../tip3p/charmm36/run2/traj.1.12' as Amber NetCDF Reading '../../tip3p/charmm36/run2/traj.1.13' as Amber NetCDF Reading '../../tip3p/charmm36/run2/traj.1.14' as Amber NetCDF Reading '../../tip3p/charmm36/run2/traj.1.15' as Amber NetCDF Reading '../../tip3p/charmm36/run2/traj.1.16' as Amber NetCDF Reading '../../tip3p/charmm36/run2/traj.1.17' as Amber NetCDF Reading '../../tip3p/charmm36/run2/traj.1.18' as Amber NetCDF [trajin ../../opc/ff12sb/run1/traj.1.01 remdtraj remdtrajtemp 298.41 trajnames ../../opc/ff12sb/run1/traj.1.02,../../opc/ff12sb/run1/traj.1.03,../../opc/ff12sb/run1/traj.1.04,../../opc/ff12sb/run1/traj.1.05,../../opc/ff12sb/run1/traj.1.06,../../opc/ff12sb/run1/traj.1.07,../../opc/ff12sb/run1/traj.1.08,../../opc/ff12sb/run1/traj.1.09,../../opc/ff12sb/run1/traj.1.10,../../opc/ff12sb/run1/traj.1.11,../../opc/ff12sb/run1/traj.1.12,../../opc/ff12sb/run1/traj.1.13,../../opc/ff12sb/run1/traj.1.14,../../opc/ff12sb/run1/traj.1.15,../../opc/ff12sb/run1/traj.1.16,../../opc/ff12sb/run1/traj.1.17,../../opc/ff12sb/run1/traj.1.18 parm [opc-ff12sb]] Reading '../../opc/ff12sb/run1/traj.1.01' as Amber NetCDF Reading '../../opc/ff12sb/run1/traj.1.02' as Amber NetCDF Reading '../../opc/ff12sb/run1/traj.1.03' as Amber NetCDF Reading '../../opc/ff12sb/run1/traj.1.04' as Amber NetCDF Reading '../../opc/ff12sb/run1/traj.1.05' as Amber NetCDF Reading '../../opc/ff12sb/run1/traj.1.06' as Amber NetCDF Reading '../../opc/ff12sb/run1/traj.1.07' as Amber NetCDF Reading '../../opc/ff12sb/run1/traj.1.08' as Amber NetCDF Reading '../../opc/ff12sb/run1/traj.1.09' as Amber NetCDF Reading '../../opc/ff12sb/run1/traj.1.10' as Amber NetCDF Reading '../../opc/ff12sb/run1/traj.1.11' as Amber NetCDF Reading '../../opc/ff12sb/run1/traj.1.12' as Amber NetCDF Reading '../../opc/ff12sb/run1/traj.1.13' as Amber NetCDF Reading '../../opc/ff12sb/run1/traj.1.14' as Amber NetCDF Reading '../../opc/ff12sb/run1/traj.1.15' as Amber NetCDF Reading '../../opc/ff12sb/run1/traj.1.16' as Amber NetCDF Reading '../../opc/ff12sb/run1/traj.1.17' as Amber NetCDF Reading '../../opc/ff12sb/run1/traj.1.18' as Amber NetCDF [trajin ../../opc/ff12sb/run2/traj.1.01 remdtraj remdtrajtemp 298.41 trajnames ../../opc/ff12sb/run2/traj.1.02,../../opc/ff12sb/run2/traj.1.03,../../opc/ff12sb/run2/traj.1.04,../../opc/ff12sb/run2/traj.1.05,../../opc/ff12sb/run2/traj.1.06,../../opc/ff12sb/run2/traj.1.07,../../opc/ff12sb/run2/traj.1.08,../../opc/ff12sb/run2/traj.1.09,../../opc/ff12sb/run2/traj.1.10,../../opc/ff12sb/run2/traj.1.11,../../opc/ff12sb/run2/traj.1.12,../../opc/ff12sb/run2/traj.1.13,../../opc/ff12sb/run2/traj.1.14,../../opc/ff12sb/run2/traj.1.15,../../opc/ff12sb/run2/traj.1.16,../../opc/ff12sb/run2/traj.1.17,../../opc/ff12sb/run2/traj.1.18 parm [opc-ff12sb]] Reading '../../opc/ff12sb/run2/traj.1.01' as Amber NetCDF Reading '../../opc/ff12sb/run2/traj.1.02' as Amber NetCDF Reading '../../opc/ff12sb/run2/traj.1.03' as Amber NetCDF Reading '../../opc/ff12sb/run2/traj.1.04' as Amber NetCDF Reading '../../opc/ff12sb/run2/traj.1.05' as Amber NetCDF Reading '../../opc/ff12sb/run2/traj.1.06' as Amber NetCDF Reading '../../opc/ff12sb/run2/traj.1.07' as Amber NetCDF Reading '../../opc/ff12sb/run2/traj.1.08' as Amber NetCDF Reading '../../opc/ff12sb/run2/traj.1.09' as Amber NetCDF Reading '../../opc/ff12sb/run2/traj.1.10' as Amber NetCDF Reading '../../opc/ff12sb/run2/traj.1.11' as Amber NetCDF Reading '../../opc/ff12sb/run2/traj.1.12' as Amber NetCDF Reading '../../opc/ff12sb/run2/traj.1.13' as Amber NetCDF Reading '../../opc/ff12sb/run2/traj.1.14' as Amber NetCDF Reading '../../opc/ff12sb/run2/traj.1.15' as Amber NetCDF Reading '../../opc/ff12sb/run2/traj.1.16' as Amber NetCDF Reading '../../opc/ff12sb/run2/traj.1.17' as Amber NetCDF Reading '../../opc/ff12sb/run2/traj.1.18' as Amber NetCDF [trajin ../../opc/dacP-ff12sb/run1/traj.1.01 remdtraj remdtrajtemp 298.41 trajnames ../../opc/dacP-ff12sb/run1/traj.1.02,../../opc/dacP-ff12sb/run1/traj.1.03,../../opc/dacP-ff12sb/run1/traj.1.04,../../opc/dacP-ff12sb/run1/traj.1.05,../../opc/dacP-ff12sb/run1/traj.1.06,../../opc/dacP-ff12sb/run1/traj.1.07,../../opc/dacP-ff12sb/run1/traj.1.08,../../opc/dacP-ff12sb/run1/traj.1.09,../../opc/dacP-ff12sb/run1/traj.1.10,../../opc/dacP-ff12sb/run1/traj.1.11,../../opc/dacP-ff12sb/run1/traj.1.12,../../opc/dacP-ff12sb/run1/traj.1.13,../../opc/dacP-ff12sb/run1/traj.1.14,../../opc/dacP-ff12sb/run1/traj.1.15,../../opc/dacP-ff12sb/run1/traj.1.16,../../opc/dacP-ff12sb/run1/traj.1.17,../../opc/dacP-ff12sb/run1/traj.1.18 parm [opc-dacP-ff12sb]] Reading '../../opc/dacP-ff12sb/run1/traj.1.01' as Amber NetCDF Reading '../../opc/dacP-ff12sb/run1/traj.1.02' as Amber NetCDF Reading '../../opc/dacP-ff12sb/run1/traj.1.03' as Amber NetCDF Reading '../../opc/dacP-ff12sb/run1/traj.1.04' as Amber NetCDF Reading '../../opc/dacP-ff12sb/run1/traj.1.05' as Amber NetCDF Reading '../../opc/dacP-ff12sb/run1/traj.1.06' as Amber NetCDF Reading '../../opc/dacP-ff12sb/run1/traj.1.07' as Amber NetCDF Reading '../../opc/dacP-ff12sb/run1/traj.1.08' as Amber NetCDF Reading '../../opc/dacP-ff12sb/run1/traj.1.09' as Amber NetCDF Reading '../../opc/dacP-ff12sb/run1/traj.1.10' as Amber NetCDF Reading '../../opc/dacP-ff12sb/run1/traj.1.11' as Amber NetCDF Reading '../../opc/dacP-ff12sb/run1/traj.1.12' as Amber NetCDF Reading '../../opc/dacP-ff12sb/run1/traj.1.13' as Amber NetCDF Reading '../../opc/dacP-ff12sb/run1/traj.1.14' as Amber NetCDF Reading '../../opc/dacP-ff12sb/run1/traj.1.15' as Amber NetCDF Reading '../../opc/dacP-ff12sb/run1/traj.1.16' as Amber NetCDF Reading '../../opc/dacP-ff12sb/run1/traj.1.17' as Amber NetCDF Reading '../../opc/dacP-ff12sb/run1/traj.1.18' as Amber NetCDF [trajin ../../opc/dacP-ff12sb/run2/traj.1.01 remdtraj remdtrajtemp 298.41 trajnames ../../opc/dacP-ff12sb/run2/traj.1.02,../../opc/dacP-ff12sb/run2/traj.1.03,../../opc/dacP-ff12sb/run2/traj.1.04,../../opc/dacP-ff12sb/run2/traj.1.05,../../opc/dacP-ff12sb/run2/traj.1.06,../../opc/dacP-ff12sb/run2/traj.1.07,../../opc/dacP-ff12sb/run2/traj.1.08,../../opc/dacP-ff12sb/run2/traj.1.09,../../opc/dacP-ff12sb/run2/traj.1.10,../../opc/dacP-ff12sb/run2/traj.1.11,../../opc/dacP-ff12sb/run2/traj.1.12,../../opc/dacP-ff12sb/run2/traj.1.13,../../opc/dacP-ff12sb/run2/traj.1.14,../../opc/dacP-ff12sb/run2/traj.1.15,../../opc/dacP-ff12sb/run2/traj.1.16,../../opc/dacP-ff12sb/run2/traj.1.17,../../opc/dacP-ff12sb/run2/traj.1.18 parm [opc-dacP-ff12sb]] Reading '../../opc/dacP-ff12sb/run2/traj.1.01' as Amber NetCDF Reading '../../opc/dacP-ff12sb/run2/traj.1.02' as Amber NetCDF Reading '../../opc/dacP-ff12sb/run2/traj.1.03' as Amber NetCDF Reading '../../opc/dacP-ff12sb/run2/traj.1.04' as Amber NetCDF Reading '../../opc/dacP-ff12sb/run2/traj.1.05' as Amber NetCDF Reading '../../opc/dacP-ff12sb/run2/traj.1.06' as Amber NetCDF Reading '../../opc/dacP-ff12sb/run2/traj.1.07' as Amber NetCDF Reading '../../opc/dacP-ff12sb/run2/traj.1.08' as Amber NetCDF Reading '../../opc/dacP-ff12sb/run2/traj.1.09' as Amber NetCDF Reading '../../opc/dacP-ff12sb/run2/traj.1.10' as Amber NetCDF Reading '../../opc/dacP-ff12sb/run2/traj.1.11' as Amber NetCDF Reading '../../opc/dacP-ff12sb/run2/traj.1.12' as Amber NetCDF Reading '../../opc/dacP-ff12sb/run2/traj.1.13' as Amber NetCDF Reading '../../opc/dacP-ff12sb/run2/traj.1.14' as Amber NetCDF Reading '../../opc/dacP-ff12sb/run2/traj.1.15' as Amber NetCDF Reading '../../opc/dacP-ff12sb/run2/traj.1.16' as Amber NetCDF Reading '../../opc/dacP-ff12sb/run2/traj.1.17' as Amber NetCDF Reading '../../opc/dacP-ff12sb/run2/traj.1.18' as Amber NetCDF [autoimage origin] AUTOIMAGE: To origin based on center of mass, anchor is first molecule. [strip :WAT,Na+,Cl-] STRIP: Stripping atoms in mask [:WAT,Na+,Cl-] [rmsd :1-2&!@H= first mass] RMSD: (:1-2&!@H*), reference is first frame (:1-2&!@H*), with fitting, mass-weighted. [cluster :1@C5',C3',C8,N3,N6,:2@P,C5',C3',C8,N3,N6 summary clust-summary.dat repout rep repfmt pdb clusterout ctraj clusterfmt netcdf dbscan minpoints 25 epsilon 0.5 sievetoframe sieve 200 random loadpairdist pairdist CpptrajPairDist summaryhalf split.dat splitframe 50000,100000,150000,200000,250000,300000,350000,400000,450000,500000,550000,600000] CLUSTER: Using coords dataset _DEFAULTCRD_, clustering using RMSD (mask [:1@C5',C3',C8,N3,N6,:2@P,C5',C3',C8,N3,N6]) best-fit DBSCAN: Minimum pts to form cluster= 25 Cluster distance criterion= 0.500 Sieved frames will only be added back if they are within 0.500 of a frame in an existing cluster. (This option is more accurate and will identify sieved frames as noise but is slower.) Initial clustering will be randomly sieved (with value 200). Previously calcd pair distances CpptrajPairDist will be used if found. Summary of cluster results will be written to clust-summary.dat Summary comparing parts of trajectory data for clusters will be written to split.dat Frames will be split at: 50000 100000 150000 200000 250000 300000 350000 400000 450000 500000 550000 600000 Cluster trajectories will be written to ctraj, format Amber NetCDF Cluster representatives will be written to separate trajectories, prefix (rep), format PDB Warning: One or more analyses requested creation of default COORDS DataSet. CREATECRD: Saving coordinates from Top full.topo.hmr to "_DEFAULTCRD_" ---------- RUN BEGIN ------------------------------------------------- PARAMETER FILES (6 total): 0: [tip3p-ff12sb] full.topo.hmr, 3301 atoms, 1088 res, box: Orthogonal, 1087 mol, 1075 solvent 1: [tip3p-dacP-ff12sb] full.topo.hmr, 3301 atoms, 1088 res, box: Orthogonal, 1087 mol, 1075 solvent 2: [tip3p-chen-garcia] full.topo.hmr, 3301 atoms, 1088 res, box: Orthogonal, 1087 mol, 1075 solvent 3: [tip3p-charmm36] full.topo.hmr, 3301 atoms, 1088 res, box: Orthogonal, 1087 mol, 1075 solvent 4: [opc-ff12sb] full.topo.hmr, 4368 atoms, 1086 res, box: Orthogonal, 1085 mol, 1073 solvent 5: [opc-dacP-ff12sb] full.topo.hmr, 4368 atoms, 1086 res, box: Orthogonal, 1085 mol, 1073 solvent INPUT TRAJECTORIES (12 total): 0: REMD trajectories (18 total), lowest replica 'traj.1.01' (reading 50000 of 50000) Looking for frames at 298.41 K 1: REMD trajectories (18 total), lowest replica 'traj.1.01' (reading 50000 of 50000) Looking for frames at 298.41 K 2: REMD trajectories (18 total), lowest replica 'traj.1.01' (reading 50000 of 50000) Looking for frames at 298.41 K 3: REMD trajectories (18 total), lowest replica 'traj.1.01' (reading 50000 of 50000) Looking for frames at 298.41 K 4: REMD trajectories (18 total), lowest replica 'traj.1.01' (reading 50000 of 50000) Looking for frames at 298.41 K 5: REMD trajectories (18 total), lowest replica 'traj.1.01' (reading 50000 of 50000) Looking for frames at 298.41 K 6: REMD trajectories (18 total), lowest replica 'traj.1.01' (reading 50000 of 50000) Looking for frames at 298.41 K 7: REMD trajectories (18 total), lowest replica 'traj.1.01' (reading 50000 of 50000) Looking for frames at 298.41 K 8: REMD trajectories (18 total), lowest replica 'traj.1.01' (reading 50000 of 50000) Looking for frames at 298.41 K 9: REMD trajectories (18 total), lowest replica 'traj.1.01' (reading 50000 of 50000) Looking for frames at 298.41 K 10: REMD trajectories (18 total), lowest replica 'traj.1.01' (reading 50000 of 50000) Looking for frames at 298.41 K 11: REMD trajectories (18 total), lowest replica 'traj.1.01' (reading 50000 of 50000) Looking for frames at 298.41 K Coordinate processing will occur on 600000 frames. TIME: Run Initialization took 0.0008 seconds. BEGIN TRAJECTORY PROCESSING: REMD: OPENING 18 REMD TRAJECTORIES ..................................................... ACTION SETUP FOR PARM 'full.topo.hmr' (4 actions): 0: [autoimage origin] Anchor molecule is 1 1086 molecules are mobile. 1: [strip :WAT,Na+,Cl-] Stripping 3236 atoms. Stripped topology: 65 atoms, 2 res, box: Orthogonal, 1 mol 2: [rmsd :1-2&!@H= first mass] Target mask: [:1-2&!@H*](41) Reference mask: [:1-2&!@H*](41) Warning: Coordinates are being rotated and box coordinates are present. Warning: Unit cell vectors are NOT rotated; imaging will not be possible Warning: after the RMS-fit is performed. 3: [createcrd _DEFAULTCRD_] Warning: COORDS data sets do not store temperatures. Warning: COORDS data sets do not store times. Estimated memory usage (100000 frames): 80.400 MB ----- traj.1.01 (1-50000, 1) ----- 0% REMD: OPENING 18 REMD TRAJECTORIES ----- traj.1.01 (1-50000, 1) ----- 10% REMD: OPENING 18 REMD TRAJECTORIES ..................................................... ACTION SETUP FOR PARM 'full.topo.hmr' (4 actions): 0: [autoimage origin] Anchor molecule is 1 1086 molecules are mobile. 1: [strip :WAT,Na+,Cl-] Stripping 3236 atoms. Stripped topology: 65 atoms, 2 res, box: Orthogonal, 1 mol 2: [rmsd :1-2&!@H= first mass] Target mask: [:1-2&!@H*](41) Warning: Coordinates are being rotated and box coordinates are present. Warning: Unit cell vectors are NOT rotated; imaging will not be possible Warning: after the RMS-fit is performed. 3: [createcrd _DEFAULTCRD_] ----- traj.1.01 (1-50000, 1) ----- 20% REMD: OPENING 18 REMD TRAJECTORIES ----- traj.1.01 (1-50000, 1) ----- 30% REMD: OPENING 18 REMD TRAJECTORIES ..................................................... ACTION SETUP FOR PARM 'full.topo.hmr' (4 actions): 0: [autoimage origin] Anchor molecule is 1 1086 molecules are mobile. 1: [strip :WAT,Na+,Cl-] Stripping 3236 atoms. Stripped topology: 65 atoms, 2 res, box: Orthogonal, 1 mol 2: [rmsd :1-2&!@H= first mass] Target mask: [:1-2&!@H*](41) Warning: Coordinates are being rotated and box coordinates are present. Warning: Unit cell vectors are NOT rotated; imaging will not be possible Warning: after the RMS-fit is performed. 3: [createcrd _DEFAULTCRD_] ----- traj.1.01 (1-50000, 1) ----- 40% REMD: OPENING 18 REMD TRAJECTORIES ----- traj.1.01 (1-50000, 1) ----- REMD: OPENING 18 REMD TRAJECTORIES ..................................................... ACTION SETUP FOR PARM 'full.topo.hmr' (4 actions): 0: [autoimage origin] Anchor molecule is 1 1086 molecules are mobile. 1: [strip :WAT,Na+,Cl-] Stripping 3236 atoms. Stripped topology: 65 atoms, 2 res, box: Orthogonal, 1 mol 2: [rmsd :1-2&!@H= first mass] Target mask: [:1-2&!@H*](41) Warning: Coordinates are being rotated and box coordinates are present. Warning: Unit cell vectors are NOT rotated; imaging will not be possible Warning: after the RMS-fit is performed. 3: [createcrd _DEFAULTCRD_] ----- traj.1.01 (1-50000, 1) ----- 50% REMD: OPENING 18 REMD TRAJECTORIES ----- traj.1.01 (1-50000, 1) ----- 60% REMD: OPENING 18 REMD TRAJECTORIES ..................................................... ACTION SETUP FOR PARM 'full.topo.hmr' (4 actions): 0: [autoimage origin] Anchor molecule is 1 1084 molecules are mobile. 1: [strip :WAT,Na+,Cl-] Stripping 4303 atoms. Stripped topology: 65 atoms, 2 res, box: Orthogonal, 1 mol 2: [rmsd :1-2&!@H= first mass] Target mask: [:1-2&!@H*](41) Warning: Coordinates are being rotated and box coordinates are present. Warning: Unit cell vectors are NOT rotated; imaging will not be possible Warning: after the RMS-fit is performed. 3: [createcrd _DEFAULTCRD_] ----- traj.1.01 (1-50000, 1) ----- 70% REMD: OPENING 18 REMD TRAJECTORIES ----- traj.1.01 (1-50000, 1) ----- 80% REMD: OPENING 18 REMD TRAJECTORIES ..................................................... ACTION SETUP FOR PARM 'full.topo.hmr' (4 actions): 0: [autoimage origin] Anchor molecule is 1 1084 molecules are mobile. 1: [strip :WAT,Na+,Cl-] Stripping 4303 atoms. Stripped topology: 65 atoms, 2 res, box: Orthogonal, 1 mol 2: [rmsd :1-2&!@H= first mass] Target mask: [:1-2&!@H*](41) Warning: Coordinates are being rotated and box coordinates are present. Warning: Unit cell vectors are NOT rotated; imaging will not be possible Warning: after the RMS-fit is performed. 3: [createcrd _DEFAULTCRD_] ----- traj.1.01 (1-50000, 1) ----- 90% REMD: OPENING 18 REMD TRAJECTORIES ----- traj.1.01 (1-50000, 1) ----- 100% Complete. Read 600000 frames and processed 600000 frames. TIME: Trajectory processing: 1115.1325 s TIME: Avg. throughput= 538.0527 frames / second. ACTION OUTPUT: ANALYSIS: Performing 1 analyses: 0: [cluster :1@C5',C3',C8,N3,N6,:2@P,C5',C3',C8,N3,N6 summary clust-summary.dat repout rep repfmt pdb clusterout ctraj clusterfmt netcdf dbscan minpoints 25 epsilon 0.5 sievetoframe sieve 200 random loadpairdist pairdist CpptrajPairDist summaryhalf split.dat splitframe 50000,100000,150000,200000,250000,300000,350000,400000,450000,500000,550000,600000] Starting clustering. Mask [:1@C5',C3',C8,N3,N6,:2@P,C5',C3',C8,N3,N6] corresponds to 11 atoms. Calculating pair-wise distances. Random_Number: seed is <= 0, using wallclock time as seed (555670000) Estimated pair-wise matrix memory usage: > 17.994 MB Pair-wise matrix set up with sieve, 600000 frames, 3000 sieved frames. 0% 10% 20% 30% 40% 50% 61% 71% 80% 90% Complete. Saving pair-wise distances to CpptrajPairDist Memory used by pair-wise matrix and other cluster data: 20.994 MB Starting DBSCAN Clustering: 0% 10% 20% 30% 40% 50% 60% 70% 80% 90% 100% Complete. Restoring sieved frames. Restoring sieved frames if within 0.500 of frame in nearest cluster. Parallelizing calculation with 24 threads 0% 10% 20% 30% 40% 50% 60% 70% 80% 90% Complete. 282545 of 597000 sieved frames were discarded as noise. #Clustering: 6 clusters 600000 frames #Cluster 0 has average-distance-to-centroid 0.696392 #Cluster 1 has average-distance-to-centroid 0.795672 #Cluster 2 has average-distance-to-centroid 0.622008 #Cluster 3 has average-distance-to-centroid 0.569484 #Cluster 4 has average-distance-to-centroid 0.480259 #Cluster 5 has average-distance-to-centroid 0.461979 #DBI: 0.711038 #pSF: 235308.447046 #Algorithm: DBSCAN minpoints 25 epsilon 0.5 sieveToCentroid 0 #NOISE_FRAMES: 408 595 609 974 1112 1992 2022 2259 2508 2782 2783 2879 3329 4268 4387 4867 5024 5128 5179 5374 5410 5439 5933 6347 7408 7683 7865 8039 8544 9310 9506 9650 10632 11344 12450 12543 12950 13327 13897 14045 14392 14493 14515 14664 15743 16556 17870 17874 18104 18860 19012 19227 19498 19614 19626 20083 20277 20746 20879 20989 21236 21516 22239 22493 23067 23068 23257 23313 24848 25904 27402 27511 28671 29448 29467 30184 30370 30427 30846 30988 31536 32091 32130 32755 33064 33859 34051 34395 34427 35394 35729 35767 35772 35860 36251 36283 36618 37301 37348 37492 38166 38354 38877 39129 40731 41539 41689 42493 43010 43269 43289 43448 44375 44486 45433 46691 47119 47943 48058 48702 49031 49215 49772 49776 49932 50500 50679 50918 51938 52195 52757 53003 53184 53822 54787 55526 55532 55666 55679 56198 56580 56912 57639 58034 58199 58238 58426 58517 58938 59473 59945 61045 61105 61253 61975 62456 62714 62729 62804 63791 65001 65569 66344 66668 67842 68102 68606 68623 69479 70419 70740 72314 72411 72458 73469 73950 73999 74377 74842 75301 76547 76660 77278 77879 77981 79367 79616 79873 80322 80493 81586 82155 82173 83164 83838 84125 84167 84450 86644 87565 87631 88673 90602 90709 91855 92186 92590 92728 93396 94375 94771 95145 96119 96587 96946 97373 98373 99284 99307 99404 99483 100084 100100 100193 100413 100604 101047 101592 101734 101958 102347 102837 103042 103196 104804 105157 105738 105905 106452 107024 107175 108241 108640 108643 108653 108749 108801 109152 109424 110027 111190 111209 112165 112280 112449 113331 113388 113647 114429 115310 115757 115874 115886 117083 117312 118267 118268 118472 118486 119197 119366 119642 120947 120958 120962 121616 121700 122743 123148 123281 124063 124197 124302 124331 124676 127172 127308 128329 128333 128429 129121 130475 130925 131038 131949 132602 132625 133146 133190 134015 134175 134817 134951 135080 135426 135427 136678 136801 136864 137153 137260 137506 138353 138510 139134 139418 139618 140067 140414 140782 141079 141111 142360 143396 143772 144110 144147 144638 145433 145439 145595 146348 146962 147066 147172 148489 149151 149490 149646 150960 151182 151538 151828 152219 152252 152648 152680 153574 154127 154233 154559 155153 155783 156229 158212 158692 158903 158985 159162 160143 160237 160664 160910 161066 161205 161896 161949 164322 164548 164671 164823 165398 165538 165831 168226 169150 169683 169894 170947 172772 172855 174330 174431 174451 174919 175503 175931 176582 176877 177677 177720 177864 179032 179816 179922 180067 180630 181323 181469 181678 181694 181725 181750 181911 182558 183084 183432 183434 184591 184672 185300 185405 185408 185438 186014 187382 187980 188058 188432 188486 188735 189296 189304 189371 189514 190073 190667 192474 192667 192815 193071 193093 193467 193842 194135 194426 195840 196702 197677 198023 198107 198475 199670 199684 200214 200331 201132 201296 201405 201482 201599 202430 202671 203470 205718 205856 206019 206545 206952 207533 207872 208262 208424 208510 208943 208971 208997 209047 209101 209449 209603 209864 210316 210755 210822 210886 210931 211020 211155 211566 212237 212458 212542 213227 213231 213418 213908 214035 214276 214644 214814 215880 216587 217360 217385 217562 217755 217778 217828 218010 218016 219303 219527 219729 220018 220174 220536 221236 221286 221740 221934 222333 222966 223062 223098 223144 223202 223360 223748 224198 224631 225421 225459 226124 226416 227372 227543 227716 228152 230023 230309 230930 231051 231193 232028 232415 232600 232613 232677 233731 233908 234410 234851 235483 235629 235785 235815 236057 236507 236939 237010 237986 238010 238011 238529 238817 238870 239988 240023 240242 240271 240289 240563 240604 240728 242025 242113 242472 242486 242631 242767 242772 243455 243754 243838 244076 244863 245027 245061 245375 245484 245733 245962 246952 247282 247388 247597 247642 247831 248416 248435 248788 248800 248914 249610 250178 250535 250782 250953 251564 252054 252156 252627 252840 253018 253530 254068 254094 255104 255396 256521 256524 257555 258122 258315 258504 258581 259060 259806 260060 260128 260148 261186 262316 263494 263723 264037 264553 264744 265548 266784 266799 267027 267405 267544 268001 268060 268229 268661 268770 268812 269173 270031 270041 270073 270130 270205 270668 271051 271429 271432 271447 271858 272478 272781 273180 273186 273215 273531 273917 274665 274886 274930 275108 275732 276409 276624 276917 276963 278262 278291 278426 279120 279618 279656 279677 281050 281105 281115 281793 281960 281972 282095 282309 282486 282773 283220 283262 283953 285004 285511 286448 286801 287369 287428 287599 287621 288534 288719 288954 289170 289177 289521 289632 289720 290112 290143 291390 291526 291624 291657 292122 292379 293017 293299 293894 294035 294544 294931 295243 295713 296434 296644 296955 297662 297993 299170 299614 299620 299892 299959 300048 300128 300634 300916 301156 301247 301273 301943 302087 302243 302467 302704 303045 304020 304142 304401 304499 304673 305395 305643 305704 305750 305864 306056 306763 306869 307101 307771 307779 307818 307910 308085 308514 308564 308727 309445 309729 309867 309888 310168 310343 310447 310602 310798 310873 311071 311616 311638 313381 313459 313524 313592 314715 315295 315529 315873 315883 315919 316123 316530 316544 317035 317494 317688 317776 317838 318193 318214 318818 318918 319135 319187 319285 319518 319590 319995 320419 321058 321064 322103 322890 323026 323197 323317 323323 323446 323819 324241 324309 324567 324865 325048 325061 325763 325860 325892 326411 326692 326758 326934 327279 327329 327686 327900 328108 328300 328423 328883 329030 330008 330372 330604 330967 331081 331105 331382 331527 331575 332468 332944 333134 333637 334062 334077 334210 334243 334750 335002 335073 335317 335585 336059 337077 337084 337314 337339 337370 337562 337680 337722 337908 338082 338094 338256 338645 339240 339337 340157 340336 340488 340540 340688 340834 341370 342039 342177 342254 342419 342663 343247 343370 343619 343632 344172 344438 344497 344502 344747 344773 345386 345504 345821 345930 345958 346392 346724 346760 346940 347044 347786 347974 348050 348608 348779 348942 349074 349124 349163 349305 349424 349543 349681 349719 349931 350006 350043 350058 350631 350894 350928 351057 351198 351250 351276 351565 351616 351661 351839 352002 352311 352414 353117 353260 353501 353561 353976 354459 354894 355071 355426 355828 355953 356914 357117 357118 357200 357591 357705 358409 358845 359458 359935 360736 360913 361300 361676 361940 361942 361970 362014 362315 362711 362749 362913 363507 363554 364012 364120 364202 364314 364466 364550 365532 365925 365975 366869 366921 367123 367141 367270 367855 368140 368521 368566 368771 368900 368924 369535 370011 370188 370234 370381 370666 370910 370929 371002 371835 371983 372038 372246 372410 372714 372823 373186 373360 373474 373727 373838 373930 374126 374614 375161 375253 375599 376021 376292 376609 376777 376889 377208 377470 377761 377885 378052 379266 379700 380919 381205 381385 381735 382457 382779 382895 383162 383186 383634 383821 384031 384081 384089 384172 384178 384691 384887 385627 385881 386208 386427 386657 387876 388103 388343 388585 388961 389006 389285 389377 389441 389482 389512 389686 389941 390686 391118 391287 391445 391509 391696 391769 391813 391868 392440 393145 393926 394181 394213 394431 395434 395574 396375 396452 396636 396653 396740 396780 397133 397324 397471 397659 397682 397908 397989 398991 399388 400406 401095 401437 401469 401711 402201 403058 403308 404022 404051 406188 406201 406833 407133 407343 407622 408062 408428 408657 408787 410394 410396 410868 411173 411444 411646 411650 412633 412807 413079 413191 414693 415743 415876 416060 416158 416571 416881 416883 416936 416950 416968 417746 418061 418522 418897 419070 419138 419914 420712 421020 421694 422101 422351 422979 423657 424426 425105 426861 427080 427552 427624 427780 429315 429708 431679 431700 432005 432268 432790 432794 432943 432991 433094 433120 433391 433439 433591 433920 434677 435248 435307 435339 435417 435474 435570 435601 436070 436396 437027 437031 437337 437755 437896 438187 438394 438436 438515 438709 439249 440145 440176 440218 441111 441158 441168 442566 443294 443351 443791 443875 443928 445832 446069 446882 448266 448716 449138 450006 450552 450783 450963 451246 451573 451653 451992 452082 452413 452839 453355 453557 454973 455390 455961 456794 457647 457683 458377 458600 459137 459216 459293 459867 459935 460465 461576 461601 461637 461869 462705 463021 463571 465217 465637 467332 467853 469008 469747 469798 469896 470145 470926 473066 473898 473976 475270 475767 475942 476277 477924 478122 478207 480609 482581 482700 483182 483530 483558 484015 484640 485317 486351 486416 486476 486704 486765 486822 488063 488310 488872 489214 489552 489761 489933 490390 490426 490869 490977 491754 491792 492905 493093 494075 494876 495788 496006 497056 497247 498931 499345 500748 500865 501292 502292 502643 502717 503497 505140 506170 506594 506852 506857 508502 508721 509150 509231 510134 510158 510225 510359 510500 512445 513040 513206 513297 513439 514701 514888 515745 516155 516626 517043 517210 517521 520723 521137 521545 521843 522375 522613 522786 522939 523685 524717 524872 524907 524916 526404 527074 527679 528343 528362 528435 528470 528902 529034 529326 529902 530194 530450 531422 531909 532706 532853 533482 533647 533856 534689 534921 535013 535343 535360 535716 535747 536201 537075 537351 537974 538014 538223 538337 538708 539462 539593 539602 539869 540021 541547 541904 542180 543843 544657 545140 545426 545428 545478 545487 545519 545608 545781 546199 547413 547566 547659 547826 547898 548263 548304 548539 548785 549351 549547 549906 550523 551300 552352 552831 552913 553720 554567 555412 556092 556278 556327 556390 556440 556690 557477 558618 558694 559025 559935 560515 561806 562002 562044 562698 563078 563610 563746 565973 566027 568427 570563 571142 571154 571359 571685 572593 573143 573386 573401 573576 573626 574765 574868 577164 577716 578322 578731 578771 580386 580914 581831 582386 582412 582868 582909 583040 583612 584223 585267 585524 585661 586197 586557 586964 587396 588422 590009 591322 591700 592495 593800 593885 593917 594034 594641 594986 595157 595756 596059 596558 596820 596845 597286 597919 598118 599199 #Number_of_noise_frames: 1514 #Representative frames: 119939 147015 470422 111992 16689 144101 #Sieve value: 200 (random) #Sieved frames: 92 110 196 408 595 609 974 1062 1112 1900 1992 2022 2259 2508 2679 2782 2783 2796 2879 2947 3028 3191 3329 3421 3664 3724 3748 4211 4268 4387 4599 4867 5024 5128 5179 5374 5410 5439 5933 6200 6347 6461 6886 6915 7358 7408 7491 7683 7818 7865 7886 8039 8421 8430 8544 8682 9013 9203 9210 9215 9310 9506 9650 10213 10632 11245 11344 11601 11619 12450 12543 12950 13132 13327 13897 13953 14045 14165 14291 14392 14493 14515 14584 14664 14841 14968 15424 15554 15688 15717 15743 15782 15842 16556 16689 16795 17415 17464 17538 17589 17870 17874 17944 18073 18104 18860 19012 19068 19145 19227 19229 19498 19614 19626 19681 19734 20083 20130 20272 20277 20531 20746 20879 20989 21236 21516 21893 21895 22006 22239 22400 22493 22498 23067 23068 23257 23313 23621 24201 24293 24643 24848 25245 25392 25904 26072 26597 26768 26770 27272 27402 27511 28660 28671 28689 28851 29448 29467 30184 30370 30427 30524 30642 30675 30842 30846 30988 31231 31352 31536 32043 32091 32130 32755 33064 33859 33931 34051 34395 34403 34427 34641 35121 35153 35172 35394 35481 35675 35729 35767 35772 35860 36052 36251 36283 36618 36703 36713 37221 37301 37348 37492 37958 38146 38166 38354 38877 38899 39129 39819 40408 40731 41052 41136 41285 41418 41472 41539 41689 42289 42445 42493 42878 42910 42915 42963 43010 43056 43165 43269 43289 43448 44041 44213 44375 44442 44486 44636 44731 44735 45037 45433 46371 46691 46741 47119 47943 48030 48053 48058 48109 48224 48509 48702 48876 49031 49215 49353 49580 49643 49772 49776 49932 50500 50592 50679 50861 50873 50918 51639 51736 51748 51817 51938 52122 52136 52195 52336 52448 52611 52757 52785 52995 53003 53134 53150 53184 53262 53822 53919 54354 54568 54787 54882 54992 55115 55526 55532 55666 55679 56198 56580 56855 56912 57639 57921 58034 58199 58238 58348 58426 58517 58932 58938 59473 59637 59945 60633 60790 61045 61105 61205 61253 61695 61975 62192 62456 62713 62714 62729 62798 62804 63388 63424 63560 63791 64301 64555 64946 65001 65181 65212 65569 65871 65901 65947 65966 66344 66668 66975 67153 67308 67392 67483 67749 67805 67842 68102 68606 68623 68716 68865 69167 69385 69446 69459 69479 69699 69850 70378 70419 70543 70623 70740 71599 71633 72224 72314 72394 72411 72458 73368 73469 73887 73950 73999 74016 74126 74377 74430 74842 75144 75172 75196 75301 75377 76547 76660 76832 77278 77879 77981 78033 79131 79363 79367 79616 79873 80038 80322 80465 80493 80738 81586 81631 81972 82007 82155 82173 82586 82875 82887 82944 83164 83838 84125 84167 84433 84450 84514 84538 85722 85760 85780 85787 86211 86640 86644 86725 87247 87252 87337 87565 87631 87662 88041 88135 88189 88515 88673 88674 89167 89400 90331 90602 90709 90819 90830 91114 91157 91280 91813 91855 92186 92448 92590 92671 92728 92772 92950 93396 93756 93892 94211 94375 94414 94771 95074 95075 95089 95145 95408 95661 95854 96119 96184 96587 96946 96947 97373 97583 98344 98373 99158 99236 99284 99307 99404 99433 99483 99774 99833 99957 100084 100100 100193 100237 100413 100572 100604 100730 101047 101592 101734 101958 102347 102837 103042 103196 103767 103991 104056 104659 104761 104804 105157 105738 105812 105835 105905 106128 106234 106452 107024 107175 107519 107790 108092 108171 108241 108370 108385 108542 108640 108643 108653 108657 108676 108749 108801 108909 109152 109424 110027 110771 111190 111209 111351 111668 111972 111992 112131 112165 112280 112308 112449 112662 113127 113289 113331 113388 113576 113636 113647 113720 113821 113885 114429 114711 114816 115234 115310 115492 115757 115874 115879 115886 115916 116296 117083 117312 117764 117774 117813 117998 118267 118268 118472 118486 118527 119197 119366 119642 119939 120541 120557 120578 120800 120933 120947 120958 120962 121216 121533 121616 121700 121996 122090 122695 122743 123148 123281 123507 123718 123772 123794 124063 124197 124302 124331 124335 124676 124979 125135 125269 125868 126116 126904 127172 127308 127319 128088 128329 128333 128429 128446 128989 129121 129554 130141 130475 130925 131038 131233 131949 131993 132527 132602 132625 132737 132896 133146 133190 133570 133576 134015 134172 134175 134458 134817 134951 135034 135080 135202 135274 135426 135427 136266 136678 136801 136864 137153 137260 137291 137413 137506 137552 138259 138304 138353 138475 138510 138935 139077 139134 139326 139418 139520 139618 140067 140085 140086 140289 140341 140414 140782 140999 141079 141111 142319 142333 142360 142393 142412 142452 142790 142863 143396 143670 143772 143980 144101 144110 144147 144177 144196 144460 144548 144638 144664 144673 145433 145439 145486 145595 145772 145916 145979 146348 146409 146706 146865 146962 147015 147066 147172 147467 147761 147834 148011 148282 148489 148538 148696 148856 148948 149151 149171 149490 149646 149773 150553 150960 150981 151182 151344 151375 151538 151607 151828 151948 152219 152252 152503 152648 152680 153559 153574 153723 153987 154034 154070 154127 154233 154375 154405 154559 154662 154667 154673 155022 155047 155153 155705 155783 155823 156070 156229 156497 156691 157293 157564 157582 157612 157954 158117 158176 158212 158438 158556 158584 158692 158743 158881 158903 158985 159162 159302 159692 159904 160143 160237 160244 160459 160576 160620 160664 160910 161066 161205 161573 161704 161896 161949 162033 162772 163144 163216 164322 164506 164548 164603 164657 164671 164823 164874 165131 165398 165474 165538 165549 165552 165656 165831 166481 167069 167359 167447 167706 167974 168226 168310 168497 168558 168838 168852 169150 169298 169666 169683 169894 170341 170851 170947 171513 171555 171925 172208 172772 172846 172855 172964 173581 174330 174431 174451 174547 174687 174919 175503 175678 175931 176109 176380 176456 176582 176731 176877 176917 176964 177557 177677 177720 177864 178256 178268 178590 179032 179245 179766 179816 179922 180067 180169 180493 180630 180684 181323 181469 181678 181694 181725 181738 181750 181798 181911 182024 182411 182481 182558 182600 183084 183233 183432 183434 183617 184591 184672 185300 185405 185408 185428 185438 185602 186014 186118 186355 186796 187382 187580 187598 187980 188048 188058 188432 188486 188686 188735 188962 189296 189304 189371 189514 189958 189992 190031 190073 190461 190667 190738 190837 190993 191214 191636 191741 191742 192474 192540 192667 192780 192815 193071 193093 193239 193467 193710 193842 194135 194318 194426 194983 195142 195725 195840 195998 196702 196966 197218 197280 197340 197342 197426 197676 197677 198023 198035 198107 198359 198475 198639 199502 199534 199670 199684 199915 199984 200214 200331 201132 201296 201405 201482 201599 201805 201878 201940 202430 202535 202671 203470 203803 203849 204148 205659 205718 205856 205953 206019 206545 206561 206745 206952 207000 207457 207533 207571 207872 208163 208262 208323 208332 208424 208510 208514 208943 208971 208975 208997 209047 209101 209449 209603 209715 209757 209864 210316 210651 210755 210798 210822 210886 210931 211020 211155 211500 211566 211864 212237 212255 212458 212542 213227 213231 213274 213309 213418 213908 214035 214276 214644 214814 215679 215880 216587 217078 217112 217238 217325 217360 217385 217562 217587 217755 217778 217828 217889 218010 218016 218378 218698 219066 219276 219303 219527 219729 220018 220022 220174 220322 220536 220999 221236 221286 221740 221934 222006 222186 222288 222333 222339 222966 223062 223098 223144 223202 223360 223748 224198 224631 224943 225215 225332 225373 225403 225421 225459 225848 225912 226124 226301 226416 226473 226542 226945 227007 227372 227543 227600 227716 227815 228106 228149 228152 228155 228545 228636 228752 228864 230023 230309 230372 230507 230930 231051 231193 231811 231839 232028 232282 232364 232415 232600 232613 232677 233108 233483 233640 233731 233908 234073 234282 234410 234663 234665 234725 234851 235069 235358 235483 235629 235785 235815 236055 236057 236198 236312 236351 236507 236794 236939 237010 237111 237335 237986 238010 238011 238529 238817 238870 239047 239643 239921 239988 240023 240242 240271 240289 240350 240563 240604 240673 240728 241189 242025 242113 242395 242472 242486 242631 242767 242772 243298 243455 243754 243813 243838 243849 244005 244076 244397 244798 244813 244863 244945 245027 245061 245375 245477 245484 245548 245733 245832 245906 245921 245962 246104 246914 246952 247142 247194 247213 247282 247388 247597 247615 247642 247831 248032 248301 248416 248435 248788 248800 248914 249610 250178 250535 250782 250939 250953 251564 251668 252054 252156 252348 252627 252673 252749 252840 253018 253227 253320 253530 253558 253952 254068 254094 254696 254927 255104 255276 255396 255426 256046 256521 256524 256691 256923 257555 257695 257819 258122 258315 258504 258581 258705 258742 258965 258992 259051 259060 259232 259734 259806 260060 260128 260148 260500 260850 261145 261186 261918 262316 262767 262934 263063 263163 263494 263723 264037 264090 264254 264553 264744 265548 266175 266695 266784 266799 266848 266949 266953 267027 267405 267544 268001 268060 268229 268661 268749 268770 268812 268870 269173 270031 270041 270073 270130 270205 270668 271051 271429 271432 271447 271795 271858 272101 272478 272732 272776 272781 273084 273180 273186 273215 273531 273917 274565 274665 274886 274930 275083 275108 275321 275530 275719 275732 276102 276342 276409 276445 276624 276689 276917 276963 277975 278243 278262 278291 278426 278880 278920 279045 279120 279353 279545 279618 279656 279677 279842 280442 280624 281050 281105 281115 281279 281427 281793 281960 281972 282095 282192 282309 282486 282773 282857 282867 282879 283026 283220 283262 283299 283757 283953 284128 285004 285511 285882 285901 286448 286584 286801 286987 287369 287428 287597 287599 287621 287904 288323 288370 288534 288719 288954 289051 289170 289177 289521 289632 289720 289740 289927 290112 290143 290603 291390 291526 291624 291657 291669 291894 292122 292379 292700 292776 293017 293299 293894 294035 294100 294200 294424 294544 294931 295168 295208 295243 295713 296028 296434 296538 296607 296644 296955 297662 297771 297873 297993 298192 299170 299339 299614 299620 299716 299739 299748 299892 299959 300048 300128 300634 300916 301156 301247 301273 301943 302087 302243 302365 302467 302704 303045 304020 304142 304232 304289 304401 304499 304673 304718 305395 305643 305704 305750 305864 306056 306763 306869 307101 307771 307779 307818 307910 308085 308249 308514 308564 308727 308925 309445 309729 309867 309888 310168 310343 310447 310602 310658 310798 310873 311071 311616 311638 312174 312749 313381 313459 313524 313592 314676 314715 315295 315529 315873 315883 315919 316123 316530 316544 316709 317035 317494 317688 317744 317776 317838 318101 318193 318214 318818 318918 319135 319187 319204 319285 319518 319590 319995 320419 320677 320884 321058 321064 321080 322103 322380 322890 323026 323197 323317 323323 323351 323446 323819 324241 324309 324567 324865 324980 325048 325061 325198 325763 325860 325892 326003 326104 326411 326692 326758 326934 327279 327329 327686 327900 327995 328108 328300 328423 328883 329030 330008 330372 330604 330830 330967 331081 331105 331361 331382 331527 331575 331660 332468 332944 333134 333637 333725 334062 334077 334103 334210 334243 334467 334750 335002 335073 335317 335585 336059 336352 337077 337084 337187 337314 337339 337354 337370 337562 337680 337722 337908 338082 338094 338256 338645 339240 339337 340011 340157 340291 340336 340488 340540 340688 340834 341027 341370 341412 341578 342039 342177 342254 342419 342663 343247 343370 343433 343619 343632 344172 344438 344497 344502 344747 344773 345057 345319 345386 345504 345821 345930 345958 346392 346724 346760 346940 347044 347786 347974 348050 348311 348485 348608 348779 348849 348942 349074 349111 349124 349163 349305 349424 349543 349671 349681 349719 349931 350006 350043 350058 350339 350631 350676 350894 350928 351057 351198 351250 351276 351565 351616 351661 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414475 414693 414825 414890 415051 415742 415743 415876 416005 416060 416158 416381 416571 416749 416863 416881 416883 416936 416950 416968 416979 417045 417194 417355 417553 417746 418061 418323 418522 418697 418801 418823 418897 419070 419138 419914 420067 420089 420352 420712 421020 421294 421679 421694 422041 422101 422351 422899 422979 423219 423308 423477 423500 423528 423657 423793 424426 424659 424791 425055 425105 425281 425545 425575 425754 426215 426640 426642 426861 426875 427080 427297 427552 427624 427780 427783 427894 428257 428498 428818 429315 429708 430639 430860 431278 431679 431700 432005 432264 432268 432306 432576 432790 432794 432943 432991 433094 433120 433211 433391 433439 433591 433920 434594 434677 435090 435124 435248 435307 435339 435417 435474 435570 435601 435765 436070 436126 436229 436396 437027 437031 437244 437337 437356 437602 437674 437755 437896 438187 438394 438411 438436 438515 438544 438702 438709 438858 438999 439249 439336 439486 439938 440145 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467351 467627 467762 467853 467999 468684 469008 469242 469345 469469 469747 469784 469798 469896 469936 470145 470422 470926 471241 471262 471453 471971 472712 472748 472785 473066 473155 473358 473398 473509 473615 473898 473958 473976 474528 474679 475270 475413 475643 475651 475767 475793 475942 475951 475976 476277 476320 476398 477087 477467 477577 477630 477924 478122 478207 478250 478333 478767 478877 479695 480142 480609 480643 480951 481244 481760 481926 481973 482581 482620 482700 482929 482950 483118 483182 483443 483530 483558 483627 483977 484015 484257 484640 485317 486351 486416 486476 486704 486765 486822 487456 487611 487772 488063 488250 488310 488505 488574 488872 489010 489134 489214 489342 489535 489552 489700 489761 489933 489988 490151 490390 490426 490565 490869 490977 490988 491296 491372 491392 491447 491754 491792 492304 492591 492753 492905 492944 493093 494075 494102 494190 494196 494322 494395 494398 494551 494719 494812 494876 495064 495170 495387 495535 495788 496006 496892 497056 497247 497443 497596 497996 498159 498225 498441 498562 498931 499151 499345 499506 500436 500524 500733 500748 500865 500942 501292 502233 502292 502418 502503 502643 502717 502792 503428 503497 504295 504618 505140 505529 506010 506170 506449 506525 506594 506607 506852 506857 506955 507176 507599 508353 508450 508502 508721 509107 509108 509150 509231 509278 509353 509717 510087 510134 510158 510225 510359 510500 510505 510965 510969 511105 512445 512577 512815 513040 513134 513206 513297 513439 513708 513960 514098 514431 514701 514888 515420 515488 515745 516155 516336 516509 516626 516983 517020 517043 517210 517365 517521 517799 518606 518620 518839 519248 519451 520077 520297 520608 520723 520945 520962 521137 521144 521329 521398 521545 521670 521843 522027 522128 522191 522375 522613 522693 522786 522939 523320 523625 523669 523685 523707 524070 524153 524316 524659 524717 524872 524907 524916 524995 525309 525700 526004 526016 526404 526836 526958 527074 527132 527230 527679 527934 527950 527953 528195 528343 528362 528364 528435 528470 528729 528800 528843 528869 528893 528902 529034 529320 529326 529564 529842 529902 529903 530083 530194 530450 531068 531422 531439 531673 531785 531909 532549 532587 532706 532853 533339 533482 533647 533856 533892 533975 534521 534689 534921 535013 535129 535139 535343 535360 535716 535747 535879 536080 536201 536546 536613 536993 537075 537351 537848 537974 538014 538164 538223 538337 538685 538708 539110 539301 539462 539593 539602 539647 539869 540021 540516 540819 541503 541547 541746 541815 541847 541855 541904 542180 542514 542845 543314 543427 543478 543843 544577 544595 544657 545140 545426 545428 545478 545487 545519 545608 545709 545781 545915 545939 546030 546077 546199 546331 546610 546963 547413 547447 547566 547653 547659 547716 547826 547898 548263 548304 548539 548740 548770 548785 548935 549049 549351 549371 549547 549906 549955 550523 550756 551300 551888 552081 552352 552463 552831 552866 552913 553720 554445 554567 555148 555208 555412 555416 555483 555645 555670 555683 555768 555831 556092 556123 556278 556327 556390 556440 556690 557477 557835 558451 558618 558657 558694 559025 559487 559660 559728 559831 559935 560484 560515 560539 561066 561602 561687 561744 561806 561928 562002 562012 562044 562302 562466 562698 563000 563078 563179 563610 563746 564049 564415 564640 564649 564839 565314 565482 565541 565623 565687 565864 565876 565973 566027 566250 566370 566916 567005 567027 567860 568084 568101 568153 568229 568427 568716 569385 569405 569875 570563 570843 571142 571154 571359 571457 571640 571685 571872 572543 572593 573101 573143 573276 573386 573401 573576 573626 573783 573844 573885 574525 574765 574868 574882 575912 576035 576051 576410 576728 576920 577058 577164 577255 577716 578322 578731 578771 578902 579319 579405 579513 579755 580386 580486 580861 580914 581831 582386 582412 582722 582868 582909 583040 583238 583300 583612 583912 583939 584020 584223 584486 585267 585524 585661 585732 585788 586197 586557 586953 586964 587096 587396 587965 588126 588422 588750 589155 590009 590826 590833 591322 591700 591816 592495 592577 592740 593195 593237 593800 593885 593917 594034 594138 594268 594334 594641 594986 595157 595190 595302 595479 595540 595553 595756 596013 596059 596283 596558 596820 596845 596932 596994 597206 597286 597661 597835 597919 598118 598164 598316 598599 598682 598695 598843 599051 599054 599199 599602 599818 599946 599974 Warning: split frame 600000 is out of bounds; ignoring. Writing 'ctraj.c0' as Amber NetCDF Writing 'ctraj.c1' as Amber NetCDF Writing 'ctraj.c2' as Amber NetCDF Writing 'ctraj.c3' as Amber NetCDF Writing 'ctraj.c4' as Amber NetCDF Writing 'ctraj.c5' as Amber NetCDF Writing 'rep.c0.pdb' as PDB Warning: No PDB space group specified. Writing 'rep.c1.pdb' as PDB Warning: No PDB space group specified. Writing 'rep.c2.pdb' as PDB Warning: No PDB space group specified. Writing 'rep.c3.pdb' as PDB Warning: No PDB space group specified. Writing 'rep.c4.pdb' as PDB Warning: No PDB space group specified. Writing 'rep.c5.pdb' as PDB Warning: No PDB space group specified. Cluster timing data: TIME: Cluster Init. : 0.0004 s (0.00%) TIME: Pairwise Calc.: 0.8976 s (0.58%) TIME: Clustering : 0.1930 s (0.13%) TIME: Cluster Post. : 153.0538 s (99.29%) TIME: Total: 154.1449 s TIME: Analyses took 154.1449 seconds. DATASETS (9 total): [tip3p-ff12sb] "[tip3p-ff12sb]" (topology), size is 3301 full.topo.hmr, 3301 atoms, 1088 res, box: Orthogonal, 1087 mol, 1075 solvent [tip3p-dacP-ff12sb] "[tip3p-dacP-ff12sb]" (topology), size is 3301 full.topo.hmr, 3301 atoms, 1088 res, box: Orthogonal, 1087 mol, 1075 solvent [tip3p-chen-garcia] "[tip3p-chen-garcia]" (topology), size is 3301 full.topo.hmr, 3301 atoms, 1088 res, box: Orthogonal, 1087 mol, 1075 solvent [tip3p-charmm36] "[tip3p-charmm36]" (topology), size is 3301 full.topo.hmr, 3301 atoms, 1088 res, box: Orthogonal, 1087 mol, 1075 solvent [opc-ff12sb] "[opc-ff12sb]" (topology), size is 4368 full.topo.hmr, 4368 atoms, 1086 res, box: Orthogonal, 1085 mol, 1073 solvent [opc-dacP-ff12sb] "[opc-dacP-ff12sb]" (topology), size is 4368 full.topo.hmr, 4368 atoms, 1086 res, box: Orthogonal, 1085 mol, 1073 solvent RMSD_00006 "RMSD_00006" (double, rms), size is 600000 _DEFAULTCRD_ "_DEFAULTCRD_" (coordinates), size is 600000 (482.400 MB) Box Coords, 65 atoms Cnum_00008 "Cnum_00008" (integer), size is 600000 ---------- RUN END --------------------------------------------------- TIME: Total execution time: 1275.0073 seconds. -------------------------------------------------------------------------------- To cite CPPTRAJ use: Daniel R. Roe and Thomas E. Cheatham, III, "PTRAJ and CPPTRAJ: Software for Processing and Analysis of Molecular Dynamics Trajectory Data". J. Chem. Theory Comput., 2013, 9 (7), pp 3084-3095.