kimrojas
Follow
-
Simple_EGNN Public
Forked from Dzung93/Simple_EGNNForked from Dzung
Jupyter Notebook UpdatedNov 22, 2024 -
-
torch-deep-learning Public
A repository for PyTorch for Deep Learning Bootcamp
Jupyter Notebook UpdatedJun 27, 2024 -
CatLearn Public
Forked from SUNCAT-Center/CatLearnA machine learning environment for atomic-scale modeling in surface science and catalysis.
Python GNU General Public License v3.0 UpdatedJun 20, 2024 -
MatSciToolKit Public
Set of utilities for processing input and output data for Mat Sci softwares
Gnuplot UpdatedJun 7, 2024 -
digital-alchemy Public
A compilation of notes, recipes and workflows used or developed for doing computational material science
Jupyter Notebook UpdatedMay 25, 2024 -
ase Public
Forked from yfyh2013/aseAtomic Simulation Environment - mirror of https://gitlab.com/ase/ase
Python Other UpdatedMar 8, 2024 -
local-llms-analyse-finance Public
Forked from thu-vu92/local-llms-analyse-financeIn this project, I explored how local LLMs can be used to label data and support analyses. Specifically, I used Llama2 model to automatically categorise my bank transaction data.
Jupyter Notebook UpdatedFeb 7, 2024 -
PRML Public
Forked from vagmcs/PRMLPRML notes, proofs and algorithms implemented in Python
Jupyter Notebook GNU General Public License v3.0 UpdatedAug 20, 2023 -
-
-
machine-learning-book Public
Forked from rasbt/machine-learning-bookCode Repository for Machine Learning with PyTorch and Scikit-Learn
-
-
ghost-in-the-shell Public
Utility for managing ghost jobs in smith supercomputer
Python UpdatedMay 8, 2023 -
kotlin_tutorial Public
Collection of files created during kotlin tutorial
Kotlin UpdatedMay 1, 2023 -
-
-
Catalog of useful data processing script for Quantum Materials Design
GNU General Public License v3.0 UpdatedMar 6, 2023 -
jupyter-book Public
Forked from jupyter-book/jupyter-bookCreate beautiful, publication-quality books and documents from computational content.
Python BSD 3-Clause "New" or "Revised" License UpdatedDec 19, 2022 -
-
Machine-Learning-Review Public
Compilation of machine learning papers reviewed by lab members
UpdatedNov 15, 2022 -
Cube-Toolz Public
Forked from funkymunkycool/Cube-ToolzPython tool to manipulate Gaussian cube files
Python UpdatedAug 22, 2022 -
gofee-book Public
Tutorial on GOFEE usage with different calculators
Python Other UpdatedJul 19, 2022 -
dmol-book Public
Forked from whitead/dmol-bookDeep learning for molecules and materials book
Jupyter Notebook Other UpdatedJun 28, 2022 -
PRML algorithms implemented in Python
Jupyter Notebook MIT License UpdatedMay 14, 2022 -
Utility-Collection Public
Collection of utility scripts, instructions and many more!
Python GNU General Public License v3.0 UpdatedMar 4, 2022 -
-
coursera-deep-learning-specialization Public
Forked from amanchadha/coursera-deep-learning-specializationNotes, programming assignments and quizzes from all courses within the Coursera Deep Learning specialization offered by deeplearning.ai: (i) Neural Networks and Deep Learning; (ii) Improving Deep N…
Jupyter Notebook UpdatedNov 2, 2021 -
Compilation of Material Science codes and guide
Gnuplot GNU General Public License v3.0 UpdatedOct 29, 2021 -
read-gaussian-cube Public
Forked from gkwt/read-gaussian-cubeProgram used to read Gaussian cube file.
MATLAB UpdatedJul 14, 2021