blob: 9a6c50ee1e1fa29a46ed2d4362cfbe9632f9c1a9 (
plain)
1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
|
# nanoENGINEER-1.com Simulator Trace File, Version 050310
#
# uname -a: Linux localhost 2.6.12-12mdk #1 Fri Sep 9 18:15:22 CEST 2005 i686 AMD Athlon(tm) XP 3000+ unknown GNU/Linux
#
# CFLAGS: -g -Wmissing-prototypes -Wall
# LDFLAGS: -L/usr/lib -lm
#
# Command Line: ./simulator -i100 -f1 --dump-as-text --trace-file test_05_thermo_lmotor_anchor_measurement_jigs_reordering_7.trc test_05_thermo_lmotor_anchor_measurement_jigs_reordering_7.mmp
# Date and Time: Wed Apr 19 10:53:27 2006
# Input File: test_05_thermo_lmotor_anchor_measurement_jigs_reordering_7.mmp
# Output File: test_05_thermo_lmotor_anchor_measurement_jigs_reordering_7.xyz
# Trace File: test_05_thermo_lmotor_anchor_measurement_jigs_reordering_7.trc
#
# Run type: Dynamics.
#
# Number of Frames: 1
# Steps per Frame: 100
# Temperature: 300.0
# Number of Atoms: 23
#
# 6 columns:
# Thermo-2: temperature (K)
# Angle-4-1-2: angle (degrees)
# Dihedral-1-2-3-4: dihedral (degrees)
# Anchor-4: torque (nn-nm)
# Thermo-4: temperature (K)
# Distance-1-3: distance (angstroms)
#
# Time T.meter Angle Dihedral Anchor T.meter Distance
# picosec Thermo-2 Angle-4-1-2 Dihedral-1-2-3- Anchor-4 Thermo-4 Distance-1-3
#
0.0100 289.61 96.07593 -9.62275 0.00 326.25 10.0045
# Done:
|