Harmeet Kaur

2 Questions 4 Answers 0 Followers

Questions related from Harmeet Kaur

Can anyone suggest how to troubleshoot segmentation fault during equilibration stage of Coarse-grain simulation?

Hi. I am using Martini force-field and Gromacs package to simulate a protein-ligand complex (220 residues). The tutorial given for protein in Martini homepage doesn't say anything about charge...

08 June 2015 4,497 11 View

How can I generate parameter for nicotine in Amber?

I am unable to generate parameter for nicotine in tleap of amber. Amber parameter database doesn't have parameter for it. The force field I am using is ff12SB. Kindly suggest how I can go about...

04 February 2015 6,938 6 View