Published August 19, 2022
| Version v1
Dataset
Open
Etidocaine binding to POPC membrane, CHARMM36-SwissParam, 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
(13.4 GB)
| Name | Size | Download all |
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md5:0ba4c4b2c0471a4acb4b7d014f2f475e
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255.7 MB | Download |
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md5:6e0aecfa68e33914d2f28ebc0ccb83bf
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6.2 MB | Download |
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md5:4fc90b0d87cbc2cb5294fa2590bb301d
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15.1 MB | Download |
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md5:34c0f03f64009a4ae990f1bcca5bf5e3
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1.2 kB | Download |
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md5:e1d8f5816918f3664f4c145424d5b1ad
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2.0 MB | Download |
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md5:1a395f0a6af91c7ef5dcebfaac47d518
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524 Bytes | Download |
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md5:e15d94261c0af46d43146a3b18df5fa0
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2.9 MB | Download |
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md5:bf4ee89e3661e7c8cf64b4f48f24e1f6
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13.1 GB | Download |
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md5:53df7e7bf9494122d4b42cd628b9892a
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1.9 kB | Download |
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md5:2f8eff04c0b86add0d99764e6c6a1812
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9.5 kB | Download |