Published August 17, 2022
| Version v1
Dataset
Open
TPP binding to POPC membrane, CHARMM36-QMcharges, 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
(6.1 GB)
| Name | Size | |
|---|---|---|
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md5:53822169e691afd3c5d43cac01257110
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2.1 kB | Download |
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md5:4a1a31011b61fd4030fe92327a314193
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114.7 kB | Download |
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md5:36292caa218c1560e188b3d871b3b298
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2.1 MB | Download |
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md5:b63668fa112f3fe03310a8c9e8e9e8f7
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114.5 MB | Download |
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md5:eeec3370b831e691f2e4f68442694838
|
6.1 MB | Download |
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md5:581de531c51df42ea5e49b6ca29a7462
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13.4 MB | Download |
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md5:a9886ee2787e4f8081e468f0789185bc
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1.2 kB | Download |
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md5:0618284f19e315c94f38369324361fb0
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1.9 MB | Download |
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md5:71da2702a2cd4f0b9929d3d78ad58593
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368 Bytes | Download |
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md5:14837ec148caa294466859fd72558490
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2.5 MB | Download |
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md5:8c77d25435837d54e0076b3514a650f0
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6.0 GB | Download |