Popular repositories Loading

1. chemfiles chemfiles Public

   Forked from chemfiles/chemfiles

   Library for reading and writing chemistry files

   C++ 1

2. bientropy bientropy Public

   Forked from sandialabs/bientropy

   BiEntropy Randomness Metrics for Python

   Python 1

3. InVADo_setup InVADo_setup Public

   Forked from MarcoSchaeferT/InVADo_setup

   Python 1

4. pymod pymod Public

   Forked from pymodproject/pymod

   PyMod 3 - sequence similarity searches, multiple sequence/structure alignments, and homology modeling within PyMOL.

   Python 1

5. Uni-GBSA Uni-GBSA Public

   Forked from dptech-corp/Uni-GBSA

   An automatic workflow to perform MM/GB(PB)SA calculations from force field building, and structure optimization to free energy calculation.

   Python 1

6. PyFock PyFock Public

   Forked from manassharma07/PyFock

   An efficient and fully parallelized pure python DFT code with GPU acceleration

   Python 1