[gmx-users] only interaction inside the molecule

Du, Yu duyu at sioc.ac.cn
Thu Nov 9 10:15:28 CET 2017


>From your limited information, I suggest you have a look at the Tabulated Potentials, www.gromacs.org/Documentation/How-tos/Tabulated_Potentials


Du, Yu
PhD Student,
Shanghai Institute of Organic Chemistry
345 Ling Ling Rd., Shanghai, China. 
Zip: 200032, Tel: (86) 021 5492 5275

> -----Original Messages-----
> From: "Faezeh Pousaneh" <fpoosaneh at gmail.com>
> Sent Time: 2017-11-09 16:58:12 (Thursday)
> To: gromacs.org_gmx-users at maillist.sys.kth.se
> Cc: 
> Subject: [gmx-users] only interaction inside the molecule
> Hi,
> I would like an atom of my molecule only interact (LJ) with its own
> molecule, not the rest of system, how can I do that?
> thanks for reply,
> Best regards

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