From 0c940115afeb696582b1a9fbe3d948242281b8ac Mon Sep 17 00:00:00 2001 From: Sebastian Kloth Date: Thu, 8 Feb 2024 17:24:44 +0100 Subject: [PATCH] Fixed LSI --- src/mdevaluate/extra/water.py | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/src/mdevaluate/extra/water.py b/src/mdevaluate/extra/water.py index 0e72f22..5c882cc 100644 --- a/src/mdevaluate/extra/water.py +++ b/src/mdevaluate/extra/water.py @@ -265,7 +265,7 @@ def LSI( ) distributions = np.array( [ - LSI_distribution(trajectory[frame_index], trajectory, bins, selector=None) + LSI_distribution(trajectory[frame_index], bins, selector=None) for frame_index in frame_indices ] )