Then create virtual environment and install packages: conda create -n MoleculeSTM python=3.7 conda activate MoleculeSTM conda install -y -c rdkit rdkit=2020.09.1.0 conda install -y -c conda-forge -c ...
BaNDyT (Bayesian Network analisis of molecular Dynamic simulation Trajectories): software package that implements the Bayesian Network Modeling specifically attuned to the MD simulation trajectories ...