create_vina_command: create_vina_command

In jfores/DocTDA: What the Package Does (One Line, Title Case)

create_vina_command

Description

Function to create vina commands.

Usage

create_vina_command(x, y, z, w, exhaust = 8)

Arguments

x	Path to protein pdbqt.
y	Path to ligand pdbqt.
z	Output pathway.
w	Path to receptor pdb files.
exhaust	Exhaustiveness parameter for vina.

Examples

## Not run: 
create_vina_command(x,y,z,w,exhaust)

## End(Not run)

jfores/DocTDA documentation built on March 19, 2022, 9:37 p.m.