Published May 17, 2023
                      
                       | Version v3
                    
                    
                      
                        
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                  Updated MD trajectories for "Hidden GPCR structural transitions addressed by multiple walker supervised molecular dynamics (mwSuMD)"
Description
MD trajectories relative to the preprint "Hidden GPCR structural transitions addressed by multiple walker supervised molecular dynamics (mwSuMD)"
For a summary of all the simulations performed and the settings employed see Table S1 of the preprint:
https://www.biorxiv.org/content/10.1101/2022.10.26.513870v1
Files
      
        A1R_Gi.zip
        
      
    
    
      
        Files
         (9.9 GB)
        
      
    
    | Name | Size | Download all | 
|---|---|---|
| md5:7053fd2e683904234e9e3fb3824d26e0 | 763.9 MB | Preview Download | 
| md5:5df23bbea01f01c8ffd57b94f1164ffe | 164.4 MB | Preview Download | 
| md5:bf5b38111f5a947a9e69e14cc14c61bc | 1.2 GB | Preview Download | 
| md5:5d3ffbe1a594c14f8714096d1c6ce02b | 86.5 MB | Preview Download | 
| md5:ba1bb56fbd29aaa8333ac3165acecc90 | 251.3 MB | Preview Download | 
| md5:0b566df0f8e02e914281f0baa6f6d915 | 525.7 MB | Preview Download | 
| md5:d98f7fa30cec8a37210051b5a365b586 | 482.0 MB | Preview Download | 
| md5:4d88f9ce800286e80b49d567159a240f | 482.1 MB | Preview Download | 
| md5:4367fc90678145ee5150b9dda569d7d5 | 946.4 MB | Preview Download | 
| md5:a8fc2d3f67df44f42b48cdae35bdd5da | 1.1 GB | Preview Download | 
| md5:80456a85370daba30d1eaf609518dd24 | 840.5 MB | Preview Download | 
| md5:e98750c51d9ac1adafb52b9eb43480e8 | 1.2 GB | Preview Download | 
| md5:7a32a79293a09a2224afca880a56437a | 438.3 MB | Preview Download | 
| md5:c984a00ab2b6dcdb17ef7a86a4d0ccdc | 946.6 MB | Preview Download | 
| md5:01f3ee38407e5b6db026f82a64b639a5 | 51.0 MB | Preview Download | 
| md5:c69b5bf496707996a3b857f5ae7ab83f | 562.8 MB | Preview Download | 
Additional details
Related works
- Is described by
- 10.1101/2022.10.26.513870 (DOI)
References
- Deganutti, G. et al; BioRxiv. 2022 Oct 27 DOI: 10.1101/2022.10.26.513870