Re: [gmx-users] Experimental to Simulation Time Period Conversion

2020-02-12 Thread Justin Lemkul
On 2/12/20 8:23 AM, Peter Mawanga wrote: Thanks a lot sir for your reply. Since experiments take place over hours but the simulations can at best approach millisecond levels. I was wondering if there is an acceptable time conversion factor from experiments to simulations. For example, the sim

Re: [gmx-users] Experimental to Simulation Time Period Conversion

2020-02-12 Thread Peter Mawanga
Thanks a lot sir for your reply. Since experiments take place over hours but the simulations can at best approach millisecond levels. I was wondering if there is an acceptable time conversion factor from experiments to simulations. For example, the simulation data generated over a 350 ns period ca

Re: [gmx-users] Experimental to Simulation Time Period Conversion

2020-02-12 Thread John Whittaker
> Dear group members > > My sincere apologies for the non-Gromacs related question, but I require > this information urgently and hence posted my query here. > > Could someone please provide me with any guidelines to appropriately model > experimental processes with molecular dynamics simulations?

[gmx-users] Experimental to Simulation Time Period Conversion

2020-02-12 Thread Peter Mawanga
Dear group members My sincere apologies for the non-Gromacs related question, but I require this information urgently and hence posted my query here. Could someone please provide me with any guidelines to appropriately model experimental processes with molecular dynamics simulations? Since the s