Popular repositories Loading

1. desorption desorption Public

   Deep Neural Network Learning of Complex Binary Sorption Equilibria from Molecular Simulation Data

   Jupyter Notebook 6 4

2. MCCCS_DB MCCCS_DB Public

   Monte Carlo for Complex Chemical Systems - Data Bank

   3 1

3. MCCCS-MN_v25.1 MCCCS-MN_v25.1 Public

   Monte Carlo for Complex Chemical Systems – Minnesota version 25.1

   Fortran 3

4. PartialMolarProperties PartialMolarProperties Public

   Partial molar properties from molecular simulation using multiple linear regression

   Fortran 1 2

5. SorbMetaML SorbMetaML Public

   Predicting hydrogen storage in nanoporous materials using meta-learning

   Jupyter Notebook 1 2

6. SPP_Adsorption SPP_Adsorption Public

   Supporting information for "Adsorption of furan, hexanoic acid, and alkanes in a hierarchical zeolite at reaction conditions: insights from molecular simulations"

   Fortran 1