prajwol_pdl's repositories
AspenPlus-Python-Interface
Aspen Plus - Python interface which acts as an API to automate the design synthsis. It includes all variables for RADFRAC, DSTWU, Flash2, RYield, RPlug, RCSTR, Heater, Mixer, Splitter. It includes a optimization library implementation from scipy
cantera-jupyter
Cantera examples in the form of Jupyter notebooks
Chess-Challenge
https://youtu.be/iScy18pVR58
deepchem
Democratizing Deep-Learning for Drug Discovery, Quantum Chemistry, Materials Science and Biology
Machine-Learning-Books-With-Python
Chapter by Chapter notes, exercises and code for a variety of machine learning books using Python
ord-data
Official data repository for the Open Reaction Database
ord-schema
Schema for the Open Reaction Database
ReactionMechanismSimulator.jl
The amazing Reaction Mechanism Simulator for simulating large chemical kinetic mechanisms
reactorch
A Differentiable Reacting Flow Simulation Package in PyTorch
RMG-database
The database of chemical parameters used with Reaction Mechanism Generator
RMG-Py
Python version of the amazing Reaction Mechanism Generator (RMG).
SmartProcessAnalytics
Smart Process Analytics for predictive modeling