[gmx-users] NAG N-Acetylglucosamine force field parameters

Casalini Tommaso tommaso.casalini at chem.ethz.ch
Mon Apr 6 14:23:01 CEST 2020


Dear Javier,

NAG is surely available in the GLYCAM library, an AMBER-based force field.



Pay attention to the scaling factors when you use GLYCAM force field, especially if you use it with other AMBER-based FF  (which are mutually compatible) in GROMACS.


Best,

Tommaso

________________________________
Da: gromacs.org_gmx-users-bounces at maillist.sys.kth.se <gromacs.org_gmx-users-bounces at maillist.sys.kth.se> per conto di Javier Luque Di Salvo <jluquedisalvo at gmail.com>
Inviato: lunedì 6 aprile 2020 14:14:39
A: gromacs.org_gmx-users at maillist.sys.kth.se
Oggetto: [gmx-users] NAG N-Acetylglucosamine force field parameters

Dear Gromacs users,

Do you know where can I search for force field parameters of
N-Acetylglucosamine (NAG)? I'm interested in AMBER, CHARMM and GROMOS force
fields, my Gromacs version is 2018.3

Thanks in advance,

Javier

--

________________________________________

*Javier Luque Di Salvo*

Dipartamento di Ingegneria Chimica

Universitá Degli Studi di Palerm*o*
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