cadet / CADET-SMBLinks
A software for Simulated Moving Bed (SMB) chromatographic processes
☆10Updated 2 years ago
Alternatives and similar repositories for CADET-SMB
Users that are interested in CADET-SMB are comparing it to the libraries listed below
Sorting:
- Functions implementing the PC-SAFT equation of state, including association, electrolyte and dipole terms☆54Updated 11 months ago
- A Benchmark Implementation of COSMO-SAC☆65Updated last month
- ARC - Automatic Rate Calculator☆46Updated this week
- Ideal Adsorbed Solution Theory☆57Updated 4 years ago
- ☆44Updated 3 months ago
- Automated reaction pathway search for gas-phase molecules☆57Updated 3 months ago
- A Python library for solution chemistry☆69Updated last week
- Python Multiscale Thermochemistry Toolbox (pMuTT)☆47Updated 3 weeks ago
- ☆1Updated 2 years ago
- Software Suite for Advanced General Ensemble Simulations☆88Updated 2 years ago
- MDAnalysis wrapper around Packmol☆33Updated 2 years ago
- Code for enumerating and evaluating numerical methods for Langevin dynamics using near-equilibrium estimates of the KL-divergence. Accomp…☆13Updated 7 years ago
- A comprehensive tool for analyzing liquid solvation structure.☆53Updated 2 weeks ago
- OpenMM plugin for simulating electrochemical systems☆21Updated 10 months ago
- Python wrapper for packmol molecule packing program☆12Updated 9 years ago
- A package for deriving coarse-grain potentials using MultiState Iterative Boltzmann Inversion (MS-IBI)☆17Updated last week
- Polymer Self-Consistent Field Theory (C++/CUDA version)☆35Updated this week
- ☆77Updated 2 months ago
- The database of chemical parameters used with Reaction Mechanism Generator☆112Updated last week
- Cassandra is a Monte Carlo package to conduct atomistic simulations.☆45Updated last year
- ☆60Updated 3 weeks ago
- Flowchem is an application to simplify the control of instruments and devices commonly found in chemistry labs.☆16Updated this week
- LVPP sigma-profile database + COSMO-SAC parametrizations☆64Updated last month
- python simulation interface for molecular modeling☆96Updated 3 years ago
- A framework for conducting polymer reference interaction site model (PRISM) calculations☆42Updated 4 years ago
- Interactive Python Notebooks for Physical Chemistry☆30Updated 2 years ago
- ☆42Updated 2 weeks ago
- Interactive Jupyter Notebooks for learning the fundamentals of Density-Functional Theory (DFT)☆72Updated last month
- Playmol is a(nother) software for building molecular models☆19Updated 2 years ago
- A post-processing engine for particle simulations☆44Updated last month