Reply to Graham et al.: In silico atomistic coordinates and molecular dynamics simulation trajectories of the glucocerebrosidase–saposin C complex

To our knowledge, there are no established policies among journals on the submission of atomistic coordinates of in silico models or molecular dynamics simulation trajectories. Atomistic coordinates are customarily made available on request. However, microsecond-long molecular dynamics trajectories can range from several hundred gigabytes to terabytes in size. Our multiple simulations are no different (1), and it is therefore difficult, if not impossible, to host them on a server. All published datasets will be shared upon request. In response to the request by Graham et al. (2), we now provide a file (3) containing atomistic coordinates of the model … [↵][1]1To whom correspondence may be addressed. Email: mone.zaidi{at}mssm.edu, maria.new{at}mssm.edu, or shozeb.haider{at}ucl.ac.uk. [1]: #xref-corresp-1-1