Trajectory 69

Order parameters quality = N/A

Computational methods Simulation metadata
System 500POPC_25000SOL_48SOD_48CLA_310K_GROMOS-CKP
Author(s) ANTONIO PEON
Date 17/05/2022
DOI 10.5281/zenodo.2574691
Publication N/A
Force field GROMOS-CKP
Simulation length (ps) 100010
Trajectory size 3790035240
Pre-equilibration time 400
Time left out 0
Temperature (K) 310
Number of particles 101096
Software gromacs
Ions SOD(48), CLA(48), SOD(48), CLA(48), SOD(48), CLA(48), SOD(48), CLA(48), SOD(48), CLA(48), SOD(48), CLA(48), SOD(48), CLA(48), SOD(48), CLA(48), SOD(48), CLA(48), SOD(48), CLA(48), SOD(48), CLA(48), SOD(48), CLA(48), SOD(48), CLA(48), SOD(48), CLA(48), SOD(48), CLA(48), SOD(48), CLA(48), SOD(48), CLA(48)
Water SOL
Lipids - L1 POPC (249)
Lipids - L2 POPC (251)
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Lipids


POPC
  • Quality total: N/A
  • Quality headgroups: N/A
  • Quality tails: N/A
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Related experiments:

Article DOI Internal ID Type Temperature Actions

Order Parameters POPC

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Group sn-1

Group sn-2

Group headgroup

Group glycerol backbone

Area per lipid

Form Factor

Experimental and Molecular Dynamics based descriptors

Quality of Order Parameters : N/A
OP Quality of headgroups: N/A
OP Quality of tails: N/A
FF Quality: N/A

Bilayer thickness : 4.3 nm
Area per lipid : 62.3 Å2