From 70584ddffb91f9ca10df810ef7ef2ae8328a6a7a Mon Sep 17 00:00:00 2001 From: Greg Landrum Date: Tue, 16 Jul 2024 09:36:55 +0200 Subject: [PATCH] add link to preprint in the README (#64) --- README.md | 4 +++- 1 file changed, 3 insertions(+), 1 deletion(-) diff --git a/README.md b/README.md index 53f6e17..64fdf0d 100644 --- a/README.md +++ b/README.md @@ -1,5 +1,7 @@ # LWReg: a lightweight chemical registration system +The preprint of the application note describing `lwreg` is here: https://doi.org/10.26434/chemrxiv-2024-zrfl9 + This provides a basic registration system which can be used either as a python library or via a command-line interface. @@ -228,4 +230,4 @@ Here's the SQL to create the conformers table in sqlite when `registerConformers ``` create table conformers (conf_id integer primary key, molregno integer not null, conformer_hash text not null unique, molblock text); -``` \ No newline at end of file +```