Published August 19, 2022
| Version v1
Dataset
Open
Etidocaine binding to POPC membrane, CHARMM36-SwissParam, 280 mM, 298 K, started from overbound
Authors/Creators
Description
System info in README.yaml, including basic analysis - headgroup OP, averaged APL and repead distance, analysis performed only from eqilibrated part of the simulation, marked as "BINDINGEQ"
here:
FILES:
xtc:
NAME: [name]
SIZE: [MB]
MODIFIED: [yyyy-mm-dd time]
LENGTH: [ps]
SAVING_FREQUENCY: [ps]
BEGIN: [ps] - how much of the simulation was simulated before and is excluded
Files
Files
(5.5 GB)
| Name | Size | |
|---|---|---|
|
md5:1f57b174d92a036da662eec9849e0439
|
6.3 MB | Download |
|
md5:34c0f03f64009a4ae990f1bcca5bf5e3
|
1.2 kB | Download |
|
md5:c294969acbf2cfbbc64b20c873347cd6
|
1.6 MB | Download |
|
md5:f8b98750fb3dcf2f544859a95fd81e00
|
531 Bytes | Download |
|
md5:0afd86df8942deea6022dcd81fee9d5a
|
3.0 MB | Download |
|
md5:dbfe232ebdee24a9564b92f376b4c83e
|
5.5 GB | Download |
|
md5:4faaeb68866ba0873de3cbabc3c35239
|
1.8 kB | Download |
|
md5:c6efe40d49432be384bc7a06d3aaf94f
|
9.5 kB | Download |