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replica_3 | Horizontal SoD COM-unrestrained +100 mV with NBFIX - replica 3 | MDRepo
Records
Horizontal SoD COM-unrestrained +100 mV with NBFIX - replica 3
Experiments
replica_3
Overview
MD-A00C4G
Horizontal SoD COM-unrestrained +100 mV with NBFIX - replica 3
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Overview
Trajectory viewer
Analyses
Force Field & Water Model
Force field
CHARMM36
CGenFF
Water model
TIP3P
Simulation Parameters
Frames
5,001
Frequency
50 ps
Simulation length
250.05 ns
Timestep
2 fs
Temperature
293 K
Ensemble
NVT
Simulation Box
Box type
orthogonal
X
79.647 nm
Y
79.647 nm
Z
86.811 nm
Box volume
550,691.04 nm³
System Composition
Total system
29,014
atoms
606
residues
Protein
0
atoms
0
residues
Nucleic acids
0
atoms
0
residues
Lipids
28,044
atoms
246
residues
Carbohydrates
0
atoms
0
residues
Solvent
0
atoms
Counter-Ions
Cations (+)
170
Anions (-)
182
Total ions
352
0
residues