MDRepo
Browse
Communities
My depositions
New Deposition
EN
Log in
replica 1 | Macrolides - Descladinose azithromycin +2 | MDRepo
Records
Macrolides - Descladinose azithromycin +2
Experiments
replica 1
Overview
MD-A007Y5
Macrolides - Descladinose azithromycin +2
Back to record
Overview
Trajectory viewer
Analyses
Force Field & Water Model
Force field
N/A
Water model
TIP3P
Simulation Parameters
Frames
100,000
Frequency
10 ps
Simulation length
1,000 ns
Timestep
2 fs
Temperature
310 K
Ensemble
NPT
Simulation Box
Box type
N/A
X
5.622 nm
Y
5.224 nm
Z
4.894 nm
Box volume
143.74 nm³
System Composition
Total system
101
atoms
1
residues
Protein
0
atoms
0
residues
Nucleic acids
0
atoms
0
residues
Lipids
0
atoms
0
residues
Carbohydrates
101
atoms
1
residues
Solvent
0
atoms
Counter-Ions
Cations (+)
0
Anions (-)
0
Total ions
0
0
residues