replica 1 | Folding@home simulations of the SARS-CoV-2 spike protein | MDRepoFolding@home simulations of the SARS-CoV-2 spike protein
Openreplica 1NPT
Loading structure.
Parameters
- Frames
- 3,000
- Ensemble
- NPTconstant number of particles, pressure and temperature
- Temperature
- 300 K
- Force field
- Amber ff03
water model TIP3P
Box0.000 x 0.000 x 0.000 nmDodecahedron · 0.00 nm³ Composition- Total system51,855 atoms · 3,363 residues
- Protein51,855 atoms · 3,363 residues
- Nucleic acids0 atoms · 0 residues
- Lipids0 atoms · 0 residues
- Carbohydrates0 atoms · 0 residues
- Solvent0 atoms · 0 residues
Counter-ions- 0Cations (+)
- 0Anions (-)
- 0Total ions