[gmx-users] topology file

Soham Sarkar soham9038 at gmail.com
Sun May 27 21:44:08 CEST 2018

Concatenate the drug and the CNT into a songle file by using cat ( see
multiple protein in a box) renumber the combined gro... then take pdb from
the gro file and use it as the initial structure.. put in any topology
building server

On Mon, 28 May 2018, 1:00 am mostafa paknia, <mostafapaknia at gmail.com>

> hi
> i need to build just one topology file for two items
> one drug and one carbon nanotube (as drug carrier)
> how can i do that?
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