[gmx-developers] curious about t_mdatoms

Vishal Vaidyanathan vvishal at stanford.edu
Fri Jul 5 13:05:31 CEST 2002


Hi,
  Can somebody explain very briefly why we have a t_mdatoms structure? I
mean why take all the trouble of md2atoms() and atoms2md()? I guess it has
something to do with optimizing for speed, but a quick explanation would
help!
  This is not important for my current coding anyway, but I was just
curious. :-)
  Thanks,
								Vishal





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