[gmx-users] temperature coupling groups for homogeneous mixtures/ ionic liquids?

on system compressibility = 4.5e-5 ref_p = 1.0 gen_vel = no gen_temp= 298.0 gen_seed = 43697 Thank you, Boning Wu -- Gromacs Users mailing list * Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before

[gmx-users] Cannot obtain center-of-mass radial distribution using Gromacs 2016.1

support:disabled Build OS/arch: Linux 3.10.0-229.20.1.el7.x86_64 x86_64 Build CPU vendor: Intel Build CPU brand:Intel(R) Xeon(R) CPU E5-2650 v3 @ 2.30GHz Build CPU family: 6 Model: 63 Stepping: 2 . Thank you, Boning Wu -- Gromacs Users mailing list * Please search

[gmx-users] Calculating RDF Using Closet Atom

option in gmx that can do what I want? What else package would you suggest to use if this function is not available in gmx? Thank you in advance, Boning Wu Graduate Student, Rutgers University -- Gromacs Users mailing list * Please search the archive at http://www.gromacs.org/Support/Mailing_Lists