activephasemap

Active sampling-based strategies for constructing 'phase' maps using spectroscopic measurements

Installation instructions:

Create a conda environment

conda create --prefix ./location/envs/activephasemap/ python==3.11

and activate it in a command shell

conda activate activephasemap

1. Install botorch (this installs majority of the packages required)

pip install botorch

2. Install other common packages:

pip install matplotlib pandas openpyxl seaborn torchvision

3. Install the apdist package from here

4. Install activephasemap from the repo:

pip install -e .

or directly from github:

pip install git+https://github.com/pozzo-research-group/activephasemap.git

For an application to creating a differentiable self-driving labs of gold nanoparticles, see here