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1. JAX-ENT JAX-ENT Public

   Maximum Entropy Optimisaiton for Experimental Biophysics-Simulation Ensemble Integration using JAX.

   Python

2. boltz boltz Public

   Forked from jwohlwend/boltz

   Boltz-1 + MSA subsampling

   Python

3. ValDX ValDX Public

   A package to validate HDX-MS data and explore empirical models

   Jupyter Notebook

4. interpretable-hdxer interpretable-hdxer Public

   This is a repo to contain the figures and the manuscript for our paper:

   Jupyter Notebook

5. automatic_sentiment automatic_sentiment Public

   Art x Biology Project with Kentaro

   Python

6. multi-Topology-Frontier-Expansion-Sampling multi-Topology-Frontier-Expansion-Sampling Public

   Forked from Gonglab-THU-MD/Frontier-Expansion-Sampling

   This repo extends the original FES script to use multiple input topologies as well as accept existing trajectories from which to expand sampling from.

   Python