[gmx-users] does gromac "mdrun" produce predicted 3d structure?

Hi everyone - I have used I-TASSER to generate pdb files for missense SNPs. I understand there are some reservations about the accuracy of SNP structural changes by using homology based methods alone. Can GROMACS off anything better? I have used gmx mdrun to calculate the energy

Re: [gmx-users] does gromac "mdrun" produce predicted 3d structure?

Thanks Justin - you mention "You need actual (extensive) MD simulations to determine that" I suppose what I am after is - what software is capable of providing such MD simulations? Thanks! On 22/01/16 13:13, Justin Lemkul wrote: On 1/22/16 8:05 AM, Arron Lacey wrote: Hi ev