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replica 1 | Folding@home simulations of nsp16 | MDRepo

Folding@home simulations of nsp16

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Maxwell I. Zimmerman;

MD-A001UK

Created: 15 Feb 2023
License: This trajectory dataset is released under a Creative Commons Attribution 4.0 International Public License (opens in a new tab)

Overview
Experiments 1
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replica 1NPT

replica 1NPT

Trajectory

4,673 atomsFull system

Frames: 5,672
Temperature: 300 K

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Analysis

Parameters

Frames: 5,672
Ensemble: NPTconstant number of particles, pressure and temperature
Temperature: 300 K
Force field: Amber ff03

water model TIP3P

Atoms

4,673

Box

0.000 x 0.000 x 0.000 nmDodecahedron · 0.00 nm³

Composition

Total system4,673 atoms · 298 residues
Protein4,673 atoms · 298 residues
Nucleic acids0 atoms · 0 residues
Lipids0 atoms · 0 residues
Carbohydrates0 atoms · 0 residues
Solvent0 atoms · 0 residues

Counter-ions

0Cations (+)
0Anions (-)
0Total ions