[gmx-users] Segmentation fault (core dumped)

2013-06-06 Thread Ishwor Poudyal
Segmentation default.It says nothing regarding the input . I will be pleased if you provide me some suggestions. Ishwor Poudyal TU Nepal -- gmx-users mailing listgmx-users@gromacs.org http://lists.gromacs.org/mailman

[gmx-users] how to get the epsilon and sigma values of CO

2013-05-27 Thread Ishwor Poudyal
Dear all.I want to study simulation of carbonmonoxide in water...I get different values of force constant partial charge while searching for those constants. Can anyone help me providing the values of partial charge (of CO), force constant and lennard jones parameter epsilon and sigma used in t

[gmx-users] (no subject)

2013-05-27 Thread Ishwor Poudyal
Dear all.I want to study Diffusion coefficient of carbonmonoxide in water...I get different values of force constant partial charge while searching for those constants. Can anyone help me providing the values of partial charge (of CO), force constant and lennard jones parameter used in the simul