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184 results for “298”

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zenodo32/100

Etidocaine binding to POPC membrane, CHARMM36-SwissParam, 280 mM, 298 K, started from overbound

<p>System info in README.yaml, including basic analysis - headgroup OP,&nbsp; averaged APL and repead distance, analysis performed only from eqilibrated part of the simulation, marked as &quot;BINDINGEQ&quot;</p> <p>here:</p> <p>FILES:<br> &nbsp; xtc:<br> &nbsp;&nbsp;&nbsp; NAME: [name]<br> &nbsp;&nbsp;&nbsp; SIZE: [MB]<br> &nbsp;&nbsp;&nbsp; MODIFIED: [yyyy-mm-dd time]<br> &nbsp;&nbsp;&nbsp; LENGTH: [ps]<br> &nbsp;&nbsp;&nbsp; SAVING_FREQUENCY: [ps]<br> &nbsp;&nbsp;&nbsp; BEGIN: [ps] - how much of the simulation was simulated before and is excluded</p>

opencc-by-4.0Aug 2022View details →
zenodo32/100

Etidocaine binding to POPC membrane, CHARMM36-SwissParam, 418 mM, 298 K, started from overbound

<p>System info in README.yaml, including basic analysis - headgroup OP,&nbsp; averaged APL and repead distance, analysis performed only from eqilibrated part of the simulation, marked as &quot;BINDINGEQ&quot;</p> <p>here:</p> <p>FILES:<br> &nbsp; xtc:<br> &nbsp;&nbsp;&nbsp; NAME: [name]<br> &nbsp;&nbsp;&nbsp; SIZE: [MB]<br> &nbsp;&nbsp;&nbsp; MODIFIED: [yyyy-mm-dd time]<br> &nbsp;&nbsp;&nbsp; LENGTH: [ps]<br> &nbsp;&nbsp;&nbsp; SAVING_FREQUENCY: [ps]<br> &nbsp;&nbsp;&nbsp; BEGIN: [ps] - how much of the simulation was simulated before and is excluded</p>

opencc-by-4.0Aug 2022View details →
zenodo32/100

Simulations of POPC/cholesterol mixtures at 298 K, three system sizes, CHARMM36

<p>GROMACS input and output files. CHARMM36.</p> <p>Membranes with 64, 256, and 1024 lipids.</p> <p>Version 2: Updated with&nbsp;complete files for CHOL0_small.</p>

opencc-by-4.0Dec 2021View details →
zenodo32/100

SMS binding to POPC membrane, CHARMM36-ProteinFF, 39 mM, 298 K

<p>System info in README.yaml, including basic analysis - headgroup OP,&nbsp; averaged APL and repead distance, analysis performed only from eqilibrated part of the simulation, marked as &quot;BINDINGEQ&quot;</p> <p>here:</p> <p>FILES:<br> &nbsp; xtc:<br> &nbsp;&nbsp;&nbsp; NAME: [name]<br> &nbsp;&nbsp;&nbsp; SIZE: [MB]<br> &nbsp;&nbsp;&nbsp; MODIFIED: [yyyy-mm-dd time]<br> &nbsp;&nbsp;&nbsp; LENGTH: [ps]<br> &nbsp;&nbsp;&nbsp; SAVING_FREQUENCY: [ps]<br> &nbsp;&nbsp;&nbsp; BEGIN: [ps] - how much of the simulation was simulated before and is excluded</p>

opencc-by-4.0Aug 2022View details →
zenodo32/100

Etidocaine binding to POPC membrane, CHARMM36-ParamChem, 69 mM, 298 K

<p>System info in README.yaml, including basic analysis - headgroup OP,&nbsp; averaged APL and repead distance, analysis performed only from eqilibrated part of the simulation, marked as &quot;BINDINGEQ&quot;,</p> <p>here:</p> <p>FILES:<br> &nbsp; xtc:<br> &nbsp;&nbsp;&nbsp; NAME: [name]<br> &nbsp;&nbsp;&nbsp; SIZE: [MB]<br> &nbsp;&nbsp;&nbsp; MODIFIED: [yyyy-mm-dd time]<br> &nbsp;&nbsp;&nbsp; LENGTH: [ps]<br> &nbsp;&nbsp;&nbsp; SAVING_FREQUENCY: [ps]<br> &nbsp;&nbsp;&nbsp; BEGIN: [ps] - how much of the simulation was simulated before and is excluded</p> <p>FILES:<br> &nbsp; tpr:<br> &nbsp;&nbsp;&nbsp; GMX_VERSION:&nbsp; gromacs version used for &quot;gmx grompp&quot; creation of *.tpr file at local computer</p> <p>&nbsp; log:<br> &nbsp;&nbsp;&nbsp; GMX_VERSION:&nbsp; gromacs version used for &quot;gmx mdrun&quot; at cluster and read out from *.log file</p>

opencc-by-4.0Aug 2022View details →
zenodo32/100

Etidocaine binding to POPC membrane, CHARMM36-ParamChem, 138 mM, 298 K

<p>System info in README.yaml, including basic analysis - headgroup OP,&nbsp; averaged APL and repead distance, analysis performed only from eqilibrated part of the simulation, marked as &quot;BINDINGEQ&quot;</p> <p>here:</p> <p>FILES:<br> &nbsp; xtc:<br> &nbsp;&nbsp;&nbsp; NAME: [name]<br> &nbsp;&nbsp;&nbsp; SIZE: [MB]<br> &nbsp;&nbsp;&nbsp; MODIFIED: [yyyy-mm-dd time]<br> &nbsp;&nbsp;&nbsp; LENGTH: [ps]<br> &nbsp;&nbsp;&nbsp; SAVING_FREQUENCY: [ps]<br> &nbsp;&nbsp;&nbsp; BEGIN: [ps] - how much of the simulation was simulated before and is excluded</p>

opencc-by-4.0Aug 2022View details →
zenodo32/100

Etidocaine binding to POPC membrane, CHARMM36-SwissParam, 280 mM, 298 K

<p>System info in README.yaml, including basic analysis - headgroup OP,&nbsp; averaged APL and repead distance, analysis performed only from eqilibrated part of the simulation, marked as &quot;BINDINGEQ&quot;</p> <p>here:</p> <p>FILES:<br> &nbsp; xtc:<br> &nbsp;&nbsp;&nbsp; NAME: [name]<br> &nbsp;&nbsp;&nbsp; SIZE: [MB]<br> &nbsp;&nbsp;&nbsp; MODIFIED: [yyyy-mm-dd time]<br> &nbsp;&nbsp;&nbsp; LENGTH: [ps]<br> &nbsp;&nbsp;&nbsp; SAVING_FREQUENCY: [ps]<br> &nbsp;&nbsp;&nbsp; BEGIN: [ps] - how much of the simulation was simulated before and is excluded</p>

opencc-by-4.0Aug 2022View details →
zenodo32/100

Dibucaine binding to POPC membrane, CHARMM36-SwissParam, 123 mM, 298 K

<p>System info in README.yaml, including basic analysis - headgroup OP,&nbsp; averaged APL and repead distance, analysis performed only from eqilibrated part of the simulation, marked as &quot;BINDINGEQ&quot;</p> <p>here:</p> <p>FILES:<br> &nbsp; xtc:<br> &nbsp;&nbsp;&nbsp; NAME: [name]<br> &nbsp;&nbsp;&nbsp; SIZE: [MB]<br> &nbsp;&nbsp;&nbsp; MODIFIED: [yyyy-mm-dd time]<br> &nbsp;&nbsp;&nbsp; LENGTH: [ps]<br> &nbsp;&nbsp;&nbsp; SAVING_FREQUENCY: [ps]<br> &nbsp;&nbsp;&nbsp; BEGIN: [ps] - how much of the simulation was simulated before and is excluded</p>

opencc-by-4.0Aug 2022View details →
zenodo32/100

Etidocaine binding to POPC membrane, CHARMM36-ParamChem-ECC, 138 mM, 298 K

<p>System info in README.yaml, including basic analysis - headgroup OP,&nbsp; averaged APL and repead distance, analysis performed only from eqilibrated part of the simulation, marked as &quot;BINDINGEQ&quot;</p> <p>here:</p> <p>FILES:<br> &nbsp; xtc:<br> &nbsp;&nbsp;&nbsp; NAME: [name]<br> &nbsp;&nbsp;&nbsp; SIZE: [MB]<br> &nbsp;&nbsp;&nbsp; MODIFIED: [yyyy-mm-dd time]<br> &nbsp;&nbsp;&nbsp; LENGTH: [ps]<br> &nbsp;&nbsp;&nbsp; SAVING_FREQUENCY: [ps]<br> &nbsp;&nbsp;&nbsp; BEGIN: [ps] - how much of the simulation was simulated before and is excluded</p>

opencc-by-4.0Aug 2022View details →
zenodo32/100

Etidocaine binding to POPC membrane, CHARMM36-ParamChem, 34 mM, 298 K

<p>System info in README.yaml, including basic analysis - headgroup OP,&nbsp; averaged APL and repead distance, analysis performed only from eqilibrated part of the simulation, marked as &quot;BINDINGEQ&quot;,</p> <p>here:</p> <p>FILES:<br> &nbsp; xtc:<br> &nbsp;&nbsp;&nbsp; NAME: [name]<br> &nbsp;&nbsp;&nbsp; SIZE: [MB]<br> &nbsp;&nbsp;&nbsp; MODIFIED: [yyyy-mm-dd time]<br> &nbsp;&nbsp;&nbsp; LENGTH: [ps]<br> &nbsp;&nbsp;&nbsp; SAVING_FREQUENCY: [ps]<br> &nbsp;&nbsp;&nbsp; BEGIN: [ps] - how much of the simulation was simulated before and is excluded</p> <p>FILES:<br> &nbsp; tpr:<br> &nbsp;&nbsp;&nbsp; GMX_VERSION:&nbsp; gromacs version used for &quot;gmx grompp&quot; creation of *.tpr file at local computer</p> <p>&nbsp; log:<br> &nbsp;&nbsp;&nbsp; GMX_VERSION:&nbsp; gromacs version used for &quot;gmx mdrun&quot; at cluster and read out from *.log file</p>

opencc-by-4.0Aug 2022View details →
zenodo32/100

Etidocaine binding to POPC membrane, CHARMM36-SwissParam, 418 mM, 298 K

<p>System info in README.yaml, including basic analysis - headgroup OP,&nbsp; averaged APL and repead distance, analysis performed only from eqilibrated part of the simulation, marked as &quot;BINDINGEQ&quot;</p> <p>here:</p> <p>FILES:<br> &nbsp; xtc:<br> &nbsp;&nbsp;&nbsp; NAME: [name]<br> &nbsp;&nbsp;&nbsp; SIZE: [MB]<br> &nbsp;&nbsp;&nbsp; MODIFIED: [yyyy-mm-dd time]<br> &nbsp;&nbsp;&nbsp; LENGTH: [ps]<br> &nbsp;&nbsp;&nbsp; SAVING_FREQUENCY: [ps]<br> &nbsp;&nbsp;&nbsp; BEGIN: [ps] - how much of the simulation was simulated before and is excluded</p>

opencc-by-4.0Aug 2022View details →
zenodo32/100

Dibucaine binding to POPC membrane, CHARMM36-SwissParam, 15 mM, 298 K, started from overbound

<p>System info in README.yaml, including basic analysis - headgroup OP,&nbsp; averaged APL and repead distance, analysis performed only from eqilibrated part of the simulation, marked as &quot;BINDINGEQ&quot;</p> <p>here:</p> <p>FILES:<br> &nbsp; xtc:<br> &nbsp;&nbsp;&nbsp; NAME: [name]<br> &nbsp;&nbsp;&nbsp; SIZE: [MB]<br> &nbsp;&nbsp;&nbsp; MODIFIED: [yyyy-mm-dd time]<br> &nbsp;&nbsp;&nbsp; LENGTH: [ps]<br> &nbsp;&nbsp;&nbsp; SAVING_FREQUENCY: [ps]<br> &nbsp;&nbsp;&nbsp; BEGIN: [ps] - how much of the simulation was simulated before and is excluded</p>

opencc-by-4.0Aug 2022View details →
zenodo32/100

Etidocaine binding to POPC membrane, CHARMM36-ParamChem, 200 mM, 298 K

<p>System info in README.yaml, including basic analysis - headgroup OP,&nbsp; averaged APL and repead distance, analysis performed only from eqilibrated part of the simulation, marked as &quot;BINDINGEQ&quot;</p> <p>here:</p> <p>FILES:<br> &nbsp; xtc:<br> &nbsp;&nbsp;&nbsp; NAME: [name]<br> &nbsp;&nbsp;&nbsp; SIZE: [MB]<br> &nbsp;&nbsp;&nbsp; MODIFIED: [yyyy-mm-dd time]<br> &nbsp;&nbsp;&nbsp; LENGTH: [ps]<br> &nbsp;&nbsp;&nbsp; SAVING_FREQUENCY: [ps]<br> &nbsp;&nbsp;&nbsp; BEGIN: [ps] - how much of the simulation was simulated before and is excluded</p>

opencc-by-4.0Aug 2022View details →
zenodo32/100

SMS binding to POPC membrane, CHARMM36-ProteinFF, 41 mM, 298 K, started from overbound

<p>System info in README.yaml, including basic analysis - headgroup OP,&nbsp; averaged APL and repead distance, analysis performed only from eqilibrated part of the simulation, marked as &quot;BINDINGEQ&quot;</p> <p>here:</p> <p>FILES:<br> &nbsp; xtc:<br> &nbsp;&nbsp;&nbsp; NAME: [name]<br> &nbsp;&nbsp;&nbsp; SIZE: [MB]<br> &nbsp;&nbsp;&nbsp; MODIFIED: [yyyy-mm-dd time]<br> &nbsp;&nbsp;&nbsp; LENGTH: [ps]<br> &nbsp;&nbsp;&nbsp; SAVING_FREQUENCY: [ps]<br> &nbsp;&nbsp;&nbsp; BEGIN: [ps] - how much of the simulation was simulated before and is excluded</p>

opencc-by-4.0Aug 2022View details →
zenodo32/100

Etidocaine binding to POPC membrane, CHARMM36-SwissParam, 138 mM, 298 K, 177 600 waters

<p>System info in README.yaml, including basic analysis - headgroup OP,&nbsp; averaged APL and repead distance, analysis performed only from eqilibrated part of the simulation, marked as &quot;BINDINGEQ&quot;</p> <p>here:</p> <p>FILES:<br> &nbsp; xtc:<br> &nbsp;&nbsp;&nbsp; NAME: [name]<br> &nbsp;&nbsp;&nbsp; SIZE: [MB]<br> &nbsp;&nbsp;&nbsp; MODIFIED: [yyyy-mm-dd time]<br> &nbsp;&nbsp;&nbsp; LENGTH: [ps]<br> &nbsp;&nbsp;&nbsp; SAVING_FREQUENCY: [ps]<br> &nbsp;&nbsp;&nbsp; BEGIN: [ps] - how much of the simulation was simulated before and is excluded</p>

opencc-by-4.0Aug 2022View details →
zenodo32/100

Etidocaine binding to POPC membrane, CHARMM36-SwissParam, 138 mM, 298 K

<p>System info in README.yaml, including basic analysis - headgroup OP,&nbsp; averaged APL and repead distance, analysis performed only from eqilibrated part of the simulation, marked as &quot;BINDINGEQ&quot;</p> <p>here:</p> <p>FILES:<br> &nbsp; xtc:<br> &nbsp;&nbsp;&nbsp; NAME: [name]<br> &nbsp;&nbsp;&nbsp; SIZE: [MB]<br> &nbsp;&nbsp;&nbsp; MODIFIED: [yyyy-mm-dd time]<br> &nbsp;&nbsp;&nbsp; LENGTH: [ps]<br> &nbsp;&nbsp;&nbsp; SAVING_FREQUENCY: [ps]<br> &nbsp;&nbsp;&nbsp; BEGIN: [ps] - how much of the simulation was simulated before and is excluded</p>

opencc-by-4.0Aug 2022View details →
zenodo32/100

Genome-wide study on 72,298 individuals in Korean biobank data for 76 traits

<p>Summary statistics relevant to Nam et al. &quot;Genome-wide study on 72,298 individuals in Korean biobank data for 76 traits&quot;.</p> <p>See README.txt for details.</p>

opencc-by-4.0Sep 2022View details →
zenodo32/100

Simulations of POPC/cholesterol mixtures at 298 K, three system sizes, MacRog

<p>GROMACS input and output files. Lipid model by Maciejewski and Rog (&#39;MacRog&#39;).</p> <p>Membranes with 64, 256, and 1024 lipids.</p>

opencc-by-4.0Sep 2022View details →
zenodo32/100

FIGURE 298. Distribution map. S in Taxonomic review of the ladybird genus Sticholotis from China (Coleoptera: Coccinellidae)

FIGURE 298. Distribution map. S. dadugangensis sp. nov. (▲); S. dilatata sp. nov. (■); S. cinctipennis Weise, 1885 (●); S. illecebrosa sp. nov. ().

opennotspecifiedSep 2017View details →
zenodo32/100

FIGURES 298–304. Coniceromyia male hind femur. 298–299. C in Taxonomic revision of Coniceromyia Borgmeier (Diptera: Phoridae), with the description of three new species from Brazil

FIGURES 298–304. Coniceromyia male hind femur. 298–299. C. piricornis; 300. C. plaumanni; 301–302. C. reina; 303–304. C. sakaii (modified from Kung 2009).

opennotspecifiedMar 2016View details →

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