From a855511b842895e269a17264cd67498f3013a8b2 Mon Sep 17 00:00:00 2001
From: Krzysztof Maziarz <krmaziar@microsoft.com>
Date: Tue, 5 Sep 2023 13:29:22 +0000
Subject: [PATCH] doc(cli): Add docstring

---
 syntheseus/cli/search.py | 14 ++++++++++++++
 1 file changed, 14 insertions(+)

diff --git a/syntheseus/cli/search.py b/syntheseus/cli/search.py
index c3bb3bab..ad057c1c 100644
--- a/syntheseus/cli/search.py
+++ b/syntheseus/cli/search.py
@@ -1,3 +1,17 @@
+"""Script for running end-to-end retrosynthetic search.
+
+The supported single-step model types are listed in `syntheseus/reaction_prediction/cli/eval.py`;
+each can be combined with either MCTS or Retro* to perform search.
+
+Example invocation:
+    python ./syntheseus/cli/search.py \
+        inventory_smiles_file=[INVENTORY_SMILES_FILE_PATH] \
+        search_target="NC1=Nc2ccc(F)cc2C2CCCC12" \
+        model_class=LocalRetro \
+        model_dir=[MODEL_DIR] \
+        time_limit_s=60
+"""
+
 from __future__ import annotations
 
 import datetime