Hi GMX users,
I just installed GROMACS 2018.4 on my windows PC without GPU support. My PC is
capable of only single precision with a 64-bit memory, would this affect the
trajectory of my peptide?
Many thanks,
Neena
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On 1/12/19 10:15 AM, Neena Susan Eappen wrote:
Hi GMX users,
I just installed GROMACS 2018.4 on my windows PC without GPU support. My PC is
capable of only single precision with a 64-bit memory, would this affect the
trajectory of my peptide?
Nearly all conventional MD simulations are d
Hi Justin,
Thank you. What is the solution for this?
Neena
From: Neena Susan Eappen
Sent: Saturday, January 12, 2019 3:15:11 PM
To: gromacs.org_gmx-users@maillist.sys.kth.se
Subject: [gmx-users] Single precision enough for MD of peptide?
Hi GMX users,
I
On 1/15/19 10:39 AM, Neena Susan Eappen wrote:
Hi Justin,
Thank you. What is the solution for this?
Solution to what?
-Justin
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Justin A. Lemkul, Ph.D.
Assistant Professor
Office: 301 Fralin Hall
Lab: 303 Engel Hall
Virginia Tech Depa