Installation#

New to Python#

Setting Up Mambaforge#

If you are new to Python and want to get started quickly, you can use Mambaforge, which is a conda-like package manager configured with conda-forge.

Step 1:

Downloaded the latest Mambaforge for your platform from conda-forge/miniforge. Most users will use x86_64(amd64) for Intel and AMD processors. Mac users with Apple Silicon should use arm64(Apple Silicon) for best performance.

Next, complete the Mambaforge installation on your system.

Note

Mambaforge is a drop-in replacement for conda. If you have an existing conda installation, you can replace all following mamba commands with conda and achieve the same functionality.

If you are using Anaconda or Miniconda on Windows, you should open Anaconda Prompt instead of Miniforge Prompt.

Step 2:

Open Terminal (on Linux or maxOS) or Miniforge Prompt (on Windows, not cmd!!). Make sure you are in a conda environment - you should see (base) prepended to the command-line prompt, such as (base) C:\Users\username>.

Create an environment for AGVis (recommended)

mamba create --name agvis python=3.8

Activate the new environment with

mamba activate agvis

Note

You will need to activate the agvis environment every time in a new Miniforge Prompt or shell.

If these steps complete without error, you now have a working Python environment. See the commands at the top to Getting started AGVis.

Extra support package#

Some AGVis features require extra support packages, which are not installed by default. For example, to build the documentation, one will need to install development packages. Other packages will be required for interoperability.

The extra support packages are specified in groups. The following group names are supported, with descriptions given below:

  • dev: packages to support development such as testing and documentation

Note

Extra support packages are not supported by conda/mamba installation. One needs to install AGVis with pip.

To install packages in the dev when installing AGVis, do:

pip install agvis[dev]

To install all extra packages, do:

pip install agvis[all]

One can also inspect the requirements-extra.txt to identify the packages for manual installation.

Develop Install#

The development mode installation is for users who want to modify the code and, for example, develop new models or routines. The benefit of development mode installation is that changes to source code will be reflected immediately without re-installation.

Note

Windows users must use the development mode installation to run AGVis.

Step 1: Get AGVis source code

As a developer, you are strongly encouraged to clone the source code using git from either your fork or the original repository. Clone the repository with

git clone https://github.com/CURENT/agvis

Note

Replace the URL with yours to use your fork. With git, you can later easily update the source code and perform version control.

Alternatively, you can download the AGVis source code from CURENT/agvis and extract all files to the path of your choice. Although works, this method is discouraged because tracking changes and pushing back code edits will require significant manual efforts.

Step 2: Install dependencies

In the Mambaforge environment, use cd to change directory to the AGVis root folder. The folder should contain the setup.py file.

Install dependencies with

mamba install --file requirements.txt
mamba install --file requirements-extra.txt

Alternatively, you can install them with pip:

pip install -r requirements.txt
pip install -r requirements-extra.txt

Step 3: Install AGVis in the development mode using

python3 -m pip install -e .

Note the dot at the end. Pip will take care of the rest.

Note

The AGVis version number shown in pip list will stuck at the version that was intalled, unless AGVis is develop-installed again. It will not update automatically with git pull.

To check the latest version number, check the preamble by running the agvis command or chek the output of python -c "import agvis; print(agvis.__version__)"

Note

AGVis updates may infrequently introduce new package requirements. If you see an ImportError after updating AGVis, you can manually install the missing dependencies or redo Step 2.

Note

To install extra support packages, one can append [NAME_OF_EXTRA] to pip install -e .. For example, pip install -e .[dev] will install packages to support documentation when installing AGVis in the development, editable mode.

Updating AGVis#

Warning

If AGVis has been installed in the development mode using source code, you will need to use git or the manual approach to update the source code. In this case, Do not proceed with the following steps, as they will install a separate site-package installation on top of the development one.

Regular AGVis updates will be pushed to both conda-forge and Python package index. It is recommended to use the latest version for bug fixes and new features. We also recommended you to check the Release notes before updating to stay informed of changes that might break your downstream code.

Depending you how you installed AGVis, you will use one of the following ways to upgrade.

If you installed it from mamba or conda, run

conda install -c conda-forge --yes agvis

If you install it from PyPI (namely, through pip), run

python3 -m pip install --yes agvis