Sebastian Pujalte's Projects
AlphaFold2 non-docker setup
DScribe is a python package for creating machine learning descriptors for atomistic systems.
A julia library for analyzing ecological systems
An Elastic Net Algorithm for the Traveling Salesman Problem
A high-performance topological machine learning toolbox in Python
Python library for numerical (molecular) integration, interpolation, and differentiation.
A Python package for extending the official PyTorch that can easily obtain performance on Intel platform
Train and run GPTs with Lightning
Metacell - Single-cell mRNA Analysis
Repository to store data for Computational Methods in Neuroscience I & II assignments
Trainable, memory-efficient, and GPU-friendly PyTorch reproduction of AlphaFold 2
:triangular_ruler: Orthogonal polynomials in all shapes and sizes.
Pretrain, finetune and deploy AI models on multiple GPUs, TPUs with zero code changes.
Numerical integration (quadrature, cubature) in Python
Flexible and efficient persistent homology computation.
scikit-learn: machine learning in Python
Uniform Manifold Approximation and Projection
Uniform Manifold Approximation and Projection (UMAP) implementation in Julia