From c18847a18558df0e19a6976ce87632c4d16b8656 Mon Sep 17 00:00:00 2001 From: Giacomo Fiorin Date: Fri, 11 Oct 2024 13:50:18 -0400 Subject: [PATCH] Update README to reflect availability of Colvars in standard GROMACS --- README.md | 4 ++-- 1 file changed, 2 insertions(+), 2 deletions(-) diff --git a/README.md b/README.md index c2732eb..843a8d1 100644 --- a/README.md +++ b/README.md @@ -21,8 +21,8 @@ Support both rigid (exclude RMSD CV) and flexible (include RMSD CV) ligands and ## Requirements Python 3.6+, PySide 2, numpy, scipy, matplotlib, parmed and MDAnalysis.
-[NAMD 3.0 or later](https://www.ks.uiuc.edu/Development/Download/download.cgi?PackageName=NAMD) / [Colvars patched Gromacs](https://github.com/Colvars/colvars).
-**Note: BFEE2 uses cutting-edge features of NAMD and Colvars. We highly suggest the end-user download the devel branch of NAMD from [here](https://gitlab.com/tcbgUIUC/namd/-/tree/devel) and patch it with [Colvars](https://github.com/Colvars/colvars) to prevent possible problems.** +[NAMD 3.0 or later](https://www.ks.uiuc.edu/Development/Download/download.cgi?PackageName=NAMD) / [GROMACS 2024 or later](https://manual.gromacs.org/).
+**Note: BFEE2 uses cutting-edge features of NAMD and Colvars. We highly suggest the end-user download the devel branch of NAMD from [here](https://gitlab.com/tcbgUIUC/namd/-/tree/devel) or GROMACS from [here](https://gitlab.com/gromacs/gromacs/) and patch them with the current version of [Colvars](https://github.com/Colvars/colvars) to access new features.** ## Installation We suggest to install BFEE2 through conda. It will be safe if conda is install in a new environment