Trajectory 347

Order parameters quality = N/A

Computational methods Simulation metadata
System 128POPC_6232SOL_110CAL_220CLA_313K_TIP4p-FBmodel
Author(s) Melcr, Josef
Date 10/03/2022
DOI 10.5281/zenodo.1118980
Publication N/A
Force field ECC-lipids
Simulation length (ps) 133220
Trajectory size 1016482680
Pre-equilibration time 0
Time left out 0
Temperature (K) 313
Number of particles 42410
Software gromacs
Ions CAL(110), CLA(220), CAL(110), CLA(220), CAL(110), CLA(220), CAL(110), CLA(220), CAL(110), CLA(220), CAL(110), CLA(220), CAL(110), CLA(220), CAL(110), CLA(220), CAL(110), CLA(220), CAL(110), CLA(220), CAL(110), CLA(220), CAL(110), CLA(220), CAL(110), CLA(220), CAL(110), CLA(220), CAL(110), CLA(220), CAL(110), CLA(220), CAL(110), CLA(220)
Water SOL
Lipids - L1 POPC (64)
Lipids - L2 POPC (64)
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Lipids


POPC
  • 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 POPC

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 : 4.3 nm
Area per lipid : 61.8 Å2