Pinned Repositories
ORGANIC
Code repo for optimizing distributions of molecules.
atom
:atom: The hackable text editor
battlesheep
bitsandbytes
8-bit CUDA functions for PyTorch
blender-mol
A simple Python script to draw molecules in Blender.
ci-test
Girolami
A simple Python script for predicting liquid densities using Girolami's method.
ORGANIC
Objective-Reinforced Generative Adversarial Networks for Inverse-design Chemistry
structure-vs-folding
Code for article "Current structure predictors are not learning the physics of protein folding" by Outeiral et al. (Bioinformatics, 2022)
ORGAN
Objective-Reinforced Generative Adversarial Networks (ORGAN) for Sequence Generation Models
couteiral's Repositories
couteiral/ORGANIC
Objective-Reinforced Generative Adversarial Networks for Inverse-design Chemistry
couteiral/blender-mol
A simple Python script to draw molecules in Blender.
couteiral/structure-vs-folding
Code for article "Current structure predictors are not learning the physics of protein folding" by Outeiral et al. (Bioinformatics, 2022)
couteiral/Girolami
A simple Python script for predicting liquid densities using Girolami's method.
couteiral/atom
:atom: The hackable text editor
couteiral/battlesheep
couteiral/bitsandbytes
8-bit CUDA functions for PyTorch
couteiral/ci-test
couteiral/couteiral.github.io
Personal website
couteiral/dms_tools2
software for the analysis and visualization of deep mutational scanning data
couteiral/ImaginaryTimeEvolution
couteiral/NumericalMethods
Didactic Python implementations of simple numerical methods
couteiral/ORGANIC-1
Code repo for optimizing distributions of molecules.
couteiral/oxrse_unit_conv
Python unit conversion library for teaching collaborative GitHub techniques.
couteiral/personal-blog
Personal blog
couteiral/plumed2
Development version of plumed 2
couteiral/Pong
Simple C++ implementation of the classic Pong game
couteiral/proteinham
Python library for handling protein lattice hamiltonians
couteiral/publication-graph
couteiral/pyswarm
Particle swarm optimization (PSO) that supports constraints
couteiral/quantum-optimisation-tutorial
A lightning-fast tutorial on quantum optimisation, including some quotidian life examples (yes, really)
couteiral/quantum-protein-lattice-folding
Code for article "Investigating the potential for a limited quantum speedup on protein lattice problems" by Outeiral et al. (New Journal of Physics, 2021)
couteiral/rhorix
Python 3.3 Blender Add-On for Importing QCT Data
couteiral/RNA-Analysis
Code for "Deconvolution of Conformational Exchange from Raman Spectra of Aqueous RNA Nucleosides"
couteiral/sympy
A computer algebra system written in pure Python