[gmx-users] gromos

some description of the GROMOS force fields. The GROMACS manual also cites the GROMOS manual. Is there an easy way to get the GROMOS manual or we have to purchase the license for GROMOS MD software to get it ? Thanks in advance, Ashish. -- Ashish Gupta, Graduate Student, Chemical Engg., University

Re: [gmx-users] using fortran for xtc files

hile Fortran numbering starts from 1 etc. and also what Libraries, C flags, Fortran Flags to use. I think reading data from *.tpr files makes life easier than reading it from *.top file specially when you are reading shuffled trajectories obtained from simulations run in parallel. Mail me in case you

[gmx-users] force field

Regards, Ashish Gupta. -- Ashish Gupta, Graduate Student, Chemical Engg., University of Florida, Gainesville FL 32611 ___ gmx-users mailing listgmx-users@gromacs.org http://www.gromacs.org/mailman/listinfo/gmx-users Please don't post (un)subs

[gmx-users] using pull code with coarse grained model

.c, line: 220 Fatal error: Number of grid cells is zero. Probably the system and box collapsed. --- "Shaken, not Stirred" (J. Bond) " Regards, Ashish Gupta -- Ashish Gupta, Ph.D. Candidate, Chemical Engg., University of Florid