Trajectory 39

Order parameters quality = N/A

Computational methods Simulation metadata
System 72POPC_2866SOL_7CLA_7SOD_298K
Author(s) Ollila, O. H. Samuli; Määttä, Jukka; Monticelli, Luca
Date 16/06/2022
DOI 10.5281/zenodo.34491
Publication N/A
Force field Orange
Simulation length (ps) 60010
Trajectory size 269014676
Pre-equilibration time 60
Time left out 0
Temperature (K) 298
Number of particles 12356
Software gromacs
Ions CLA(7), SOD(7), CLA(7), SOD(7), CLA(7), SOD(7), CLA(7), SOD(7), CLA(7), SOD(7), CLA(7), SOD(7), CLA(7), SOD(7), CLA(7), SOD(7), CLA(7), SOD(7), CLA(7), SOD(7), CLA(7), SOD(7), CLA(7), SOD(7), CLA(7), SOD(7), CLA(7), SOD(7), CLA(7), SOD(7), CLA(7), SOD(7), CLA(7), SOD(7)
Water SOL
Lipids - L1 POPC (36)
Lipids - L2 POPC (36)
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Lower leaflet

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 : 63 Å2