subject:"\[gmx\-users\] TZD Tautomers"

Re: [gmx-users] TZD Tautomers

2011-01-13 Thread Tsjerk Wassenaar

Nancy, Mark already indicated that this is not the proper place to post questions like that. This forum is about gromacs, not about tautomers, docking, and certainly not about MarvinSketch. Cheers, Tsjerk On Thu, Jan 13, 2011 at 10:26 PM, Nancy wrote: > Hi All, > > I happened to find a publish

[gmx-users] TZD Tautomers

2011-01-13 Thread Nancy

Hi All, I happened to find a published article where molecular docking simulations of TZDs against a novel protein is detailed: "Structure-based design of a thiazolidinedione which targets the mitochondrial protein mitoNEET" Bioorg Med Chem Lett. 2010 Feb 1;20(3):819-23 In this paper, the author