Pinned Loading

1. UncertaintyCalculator UncertaintyCalculator Public

   Help you get rid of Physical Chemistry Experiment in CCME at PKU!

   Python 7 1

2. alphafold alphafold Public

   AlphaFold2 with an initial guess

   Python

3. pdmodels pdmodels Public

   Protein design models

   Python

4. vspp vspp Public

   A Python package for virtual screening pre- and post-processing

   Python 2

5. datanal datanal Public

   A Python package for data analysis and visualization

   Python 1

6. BiasMPNN BiasMPNN Public

   An end-to-end conformation bias prediction model based on message passing neural networks

   Jupyter Notebook