Gourav Chakraborty

2 Questions 2 Answers 0 Followers

Questions related from Gourav Chakraborty

Generating pdb from materials studio?

I am currently working on silica slab preparation. For that I have generated the supercell in materials studio, but when I tried to export this into pdb, some unusual bond connectivities...

15 September 2021 8,547 2 View

Adding a residue to a forcefield in GROMACS?

I am currently working on inorganic surfaces like silica, calcite etc. I have the values for the parameters, but I don't know how to generate the topology file. As it is a non-standard molecule, I...

11 September 2021 6,235 0 View