Published August 19, 2022
| Version v1
Dataset
Open
Etidocaine binding to POPC membrane, CHARMM36-SwissParam, 138 mM, 298 K, 177 600 waters
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
(1.7 GB)
| Name | Size | |
|---|---|---|
|
md5:85d6a1262b84882071d7c8195bf2a017
|
14.0 MB | Download |
|
md5:0492ecfd6170246a1b94d47c65f1645b
|
23.6 MB | Download |
|
md5:8b28426ec7c9029dd27866abbf8a655f
|
26.2 MB | Download |
|
md5:1ce633c0cf9031120ab5bda7eced3511
|
2.6 MB | Download |
|
md5:0de1bc6608ffd0996e7f3081c50449f4
|
1.2 kB | Download |
|
md5:42372953a603ccc77f610760f9ebc8dc
|
11.9 MB | Download |
|
md5:f7b78c3fa105187be850c7431d747dbb
|
529 Bytes | Download |
|
md5:d2ba19bf7bb29e21c83167eaa5f90589
|
18.7 MB | Download |
|
md5:fbd57b435fd57356e648e99e49282824
|
1.6 GB | Download |
|
md5:c7743132738cbaf979c7e0990127e9db
|
2.0 kB | Download |
|
md5:b899c81d6ed468519bdc961a9c7552e1
|
9.5 kB | Download |