From f94c4986e17c360d9c7a116c82863c54cf6e1cb2 Mon Sep 17 00:00:00 2001
From: JochenSiegWork <135010976+JochenSiegWork@users.noreply.github.com>
Date: Fri, 7 Feb 2025 16:20:38 +0100
Subject: [PATCH] readme: add table of contents (#121)

---
 README.md | 15 +++++++++++++++
 1 file changed, 15 insertions(+)

diff --git a/README.md b/README.md
index 4dbe6fb5..cc5ff4e8 100644
--- a/README.md
+++ b/README.md
@@ -35,6 +35,21 @@ fingerprint-based models, 2024](https://doi.org/10.1039/D4FD00095A)
 \
 Further links: [repository](https://github.com/basf/neural-fingerprint-uncertainty)
 
+# Table of Contents
+
+- [MolPipeline](#molpipeline)
+  - [Background](#background)
+  - [Publications](#publications)
+- [Table of Contents](#table-of-contents)
+  - [Installation](#installation)
+  - [Documentation](#documentation)
+  - [Quick start](#quick-start)
+    - [Model building](#model-building)
+    - [Feature calculation](#feature-calculation)
+    - [Clustering](#clustering)
+    - [Explainability](#explainability)
+  - [License](#license)
+
 ## Installation
 ```commandline
 pip install molpipeline