Trajectory 530

Order parameters quality = N/A

Computational methods Simulation metadata
System 500POPG_25000SOL_549SOD_49CLA_310K
Author(s) ANTONIO PEON
Date 17/05/2022
DOI 10.5281/zenodo.3378992
Publication N/A
Force field GROMOS-CKP-POPG-Tom_Piggot-v1
Simulation length (ps) 100010
Trajectory size 3829653224
Pre-equilibration time 400
Time left out 0
Temperature (K) 310
Number of particles 102098
Software gromacs
Ions SOD(549), CLA(49), SOD(549), CLA(49), SOD(549), CLA(49), SOD(549), CLA(49), SOD(549), CLA(49), SOD(549), CLA(49), SOD(549), CLA(49), SOD(549), CLA(49), SOD(549), CLA(49), SOD(549), CLA(49), SOD(549), CLA(49), SOD(549), CLA(49), SOD(549), CLA(49), SOD(549), CLA(49), SOD(549), CLA(49), SOD(549), CLA(49), SOD(549), CLA(49)
Water SOL
Lipids - L1 POPG (250)
Lipids - L2 POPG (250)
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Lipids


POPG
  • Quality total: N/A
  • Quality headgroups: N/A
  • Quality tails: N/A
Download Mapping File main

Related experiments:

Article DOI Internal ID Type Temperature Actions

Order Parameters POPG

Download JSON main

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 : 4.1 nm
Area per lipid : 65 Å2