From c02f12800b9df5771562e5ee2e0da2e5be5b5403 Mon Sep 17 00:00:00 2001 From: "UENO, M." Date: Fri, 23 Feb 2024 00:21:16 +0900 Subject: [PATCH] Fix a docstring to include `vinardo` for `sf_name` --- build/python/vina/vina.py | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/build/python/vina/vina.py b/build/python/vina/vina.py index b9dce8af..edfd7cf8 100644 --- a/build/python/vina/vina.py +++ b/build/python/vina/vina.py @@ -20,7 +20,7 @@ def __init__(self, sf_name='vina', cpu=0, seed=0, no_refine=False, verbosity=1): """Initialize a Vina object. Args: - sf_name (str): Scoring function name to use (Vina or ad4) (default: vina) + sf_name (str): Scoring function name to use (vina, vinardo or ad4) (default: vina) cpu (int): Number of CPU to use (default: 0; use all of them) seed (int): Random seed (default: 0; ramdomly choosed) no_refine (boolean): when receptor is provided, do not use explicit receptor atoms