MDRepo
/
Communities
My depositions
New Deposition
EN
Log in
run | MC3 lipid CpHMD parametrization: calibration run at lambda 0.60 (buffer 0.40) | MDRepo
Records
MC3 lipid CpHMD parametrization: calibration run at lambda 0.60 (buffer 0.40)
Experiments
run
Overview
MD-A00C6X
MC3 lipid CpHMD parametrization: calibration run at lambda 0.60 (buffer 0.40)
Back to record
Overview
Trajectory viewer
Analyses
Force Field & Water Model
Force field
CHARMM36
Water model
TIP3P
Simulation Parameters
Frames
21
Frequency
50 ps
Simulation length
1.05 ns
Timestep
2 fs
Temperature
300 K
Ensemble
NPT
Simulation Box
Box type
cubic
X
58.565 nm
Y
58.565 nm
Z
58.565 nm
Box volume
200,871.63 nm³
System Composition
Total system
127
atoms
2
residues
Protein
0
atoms
0
residues
Nucleic acids
0
atoms
0
residues
Lipids
0
atoms
0
residues
Carbohydrates
0
atoms
0
residues
Solvent
0
atoms
Counter-Ions
Cations (+)
0
Anions (-)
0
Total ions
0
0
residues