From 881476fcf7655d2122d899e7ffcd3ba334743673 Mon Sep 17 00:00:00 2001 From: Chun Cai Date: Sat, 24 Dec 2022 12:55:11 +0800 Subject: [PATCH] Add ABACUS to the interface part. Signed-off-by: Chun Cai --- doc/third-party/out-of-deepmd-kit.md | 4 ++++ 1 file changed, 4 insertions(+) diff --git a/doc/third-party/out-of-deepmd-kit.md b/doc/third-party/out-of-deepmd-kit.md index 4ae4d4006d..6cd5769fbf 100644 --- a/doc/third-party/out-of-deepmd-kit.md +++ b/doc/third-party/out-of-deepmd-kit.md @@ -29,3 +29,7 @@ An [AMBER](https://ambermd.org/) interface to DeePMD-kit is written by the [York ## MLatom [Mlatom](http://mlatom.com/) provides an interface to the DeePMD-kit within MLatom's workflow by calling DeePMD-kit's CLI. Details can be found in [this paper](https://doi.org/10.1007/s41061-021-00339-5). + +## ABACUS + +[ABACUS](https://github.com/deepmodeling/abacus-develop/) can run molecular dynamics with a DP model. User is required to [build ABACUS with DeePMD-kit](https://abacus.deepmodeling.com/en/latest/advanced/install.html#build-with-deepmd-kit).