Published August 18, 2022
| Version v1
Dataset
Open
Etidocaine binding to POPC membrane, CHARMM36-ParamChem-ECC, 138 mM, 298 K
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
(12.6 GB)
| Name | Size | |
|---|---|---|
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md5:be38d1735bb457930778960d81dc257e
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14.0 MB | Download |
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md5:a0dae6ea5e17d3e2db18d66893e6759d
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25.3 MB | Download |
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md5:64c39cb0c5835e073793d73fa5020d6c
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26.2 MB | Download |
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md5:674bbc76189e2a93c3860a406bf8b460
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7.5 MB | Download |
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md5:6d17946a1bc9afbb55ba91cb23aeaccb
|
557 Bytes | Download |
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md5:98a4985b08048c3db0bd02138169d5ad
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15.3 MB | Download |
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md5:dc3d68fd62e072d0e4802b5fd0a84d8c
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12.5 GB | Download |
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md5:d3ba7da843c95fa59ab96151c4561f17
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2.0 kB | Download |
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md5:813fb5212a3ba5cb54212e2a4737763e
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214.2 kB | Download |