From b970da91aa5a4f45d6ad535b80574e5fe9e0380e Mon Sep 17 00:00:00 2001 From: Chun Cai Date: Tue, 19 Mar 2024 17:15:54 +0800 Subject: [PATCH] Docs: add introduction to uni-dock benchmarks (#105) --- README.md | 8 ++++++++ 1 file changed, 8 insertions(+) diff --git a/README.md b/README.md index c6e515b..92ff2bc 100644 --- a/README.md +++ b/README.md @@ -15,11 +15,19 @@ The [paper](https://pubs.acs.org/doi/10.1021/acs.jctc.2c01145) has been accepted Please check [`unidock` folder](./unidock/) for installing instructions, source codes, and usage. +--- + **Uni-Dock Tools** is a Python package developed to handle the inputs and outputs of Uni-Dock. It is committed to support more input formats and scoring functions. We hope it could be an easy-to-use virtual screening workflow for users with diversed backgrounds. Please check [`unidock_tools` folder](./unidock_tools/) for installing instructions, source codes, and usage. +--- + +To evaluate the performance and accuracy under a uniform standard, we created **Uni-Dock Benchmarks** based on public datasets and papers. +The benchmarks are publicly available at . + + ## Changelog - 2024-02-29: Release [Uni-Dock v1.1](./unidock/README.md#changelog) and [Uni-Dock Tools](./unidock_tools/README.md).