Installation

Requiments

  • OS: Linux (compatible with CentOS 7 or later)

  • CPU: x86_64 architecture

  • GPU: NVIDIA card (Maxwell architecture or later)

  • Driver: NVIDIA driver (version 440.33 or later)

  • Disk space: 2 GB

Install with Conda

ACEMD can be installed with Conda package manager:

  1. Install Conda, if not yet available. We recommend to install the latest Miniconda following these instructions.

  2. Install ACEMD into an active (default) Conda environment:

    $ conda install -c conda-forge -c acellera acemd3
    

Alternative one, can install ACEMD into a separe Conda environment:

$ conda create -n acemd_env -c conda-forge -c acellera acemd3
$ conda activate acemd_env