Pinned Repositories
ase-espresso
ase interface for Quantum Espresso
catmap
Catalyst Micro-kinetic Analysis Package for automated creation of micro-kinetic models used in catalyst screening
GPy
Gaussian processes framework in python
kinn
Kinetics-Informed Neural Networks
low-order-reactor
CSTR modeling approach for fluidized bed reactors
mkin4py
A general linear model for microkinetic catalytic systems.
optinpy
Optimization in Python: Linear and non-linear optimization methods.
pint
Operate and manipulate physical quantities in Python
xl2py
An Excel (XL) 2 Python (Py) structure retriever for optimization. Convert the I/O of XL files into Python.
catmap
Catalyst Micro-kinetic Analysis Package for automated creation of micro-kinetic models used in catalyst screening
gusmaogabriels's Repositories
gusmaogabriels/optinpy
Optimization in Python: Linear and non-linear optimization methods.
gusmaogabriels/mkin4py
A general linear model for microkinetic catalytic systems.
gusmaogabriels/kinn
Kinetics-Informed Neural Networks
gusmaogabriels/xl2py
An Excel (XL) 2 Python (Py) structure retriever for optimization. Convert the I/O of XL files into Python.
gusmaogabriels/ase-espresso
ase interface for Quantum Espresso
gusmaogabriels/catmap
Catalyst Micro-kinetic Analysis Package for automated creation of micro-kinetic models used in catalyst screening
gusmaogabriels/GPy
Gaussian processes framework in python
gusmaogabriels/low-order-reactor
CSTR modeling approach for fluidized bed reactors
gusmaogabriels/pint
Operate and manipulate physical quantities in Python
gusmaogabriels/pyGPs
pyGPs is a library containing an object-oriented python implementation for Gaussian Process (GP) regression and classification.
gusmaogabriels/bibtextomd
Convert BibTeX entries to formatted Markdown for use with the kramdown processor
gusmaogabriels/cotools
functional tools for cooperative multitasking.
gusmaogabriels/deap
Distributed Evolutionary Algorithms in Python
gusmaogabriels/DiffEqFlux.jl
Universal neural differential equations with O(1) backprop, GPUs, and stiff+non-stiff DE solvers, demonstrating scientific machine learning (SciML) and physics-informed machine learning methods
gusmaogabriels/fastMLP
Fast batch fully connected MLP algorithm for classification using numpy memmap
gusmaogabriels/github-cheat-sheet
A list of cool features of Git and GitHub.
gusmaogabriels/gnome-cedilla-fix
A fix to make the Gnome "US-International" layouts generate a cedilla c (ç) when the user types '+c.
gusmaogabriels/jax
Composable transformations of Python+NumPy programs: differentiate, vectorize, JIT to GPU/TPU, and more
gusmaogabriels/libbeef
Library for Bayesian error estimation functionals for use in density functional theory codes
gusmaogabriels/nbconvert-examples
Examples that illustrate how nbconvert can be used
gusmaogabriels/PyDAS
A Python wrapper for the DASSL, DASPK, and DASKR differential algebraic system solvers
gusmaogabriels/pyipopt
A Python connector to IPOPT
gusmaogabriels/pyodbc
Python ODBC bridge
gusmaogabriels/q-e
gusmaogabriels/quicktest
quick test of hugo on github pages
gusmaogabriels/release
Where the IDAES releases and integration tests live
gusmaogabriels/scikit-learn
scikit-learn: machine learning in Python
gusmaogabriels/sella
gusmaogabriels/spyder
Official repository for Spyder - The Scientific PYthon Development EnviRonment
gusmaogabriels/tag2trend
A general library for handling trend series.