yuanqing-wang / scotchView external linksLinks
Scientific Computing from Scratch
☆11Oct 23, 2025Updated 3 months ago
Alternatives and similar repositories for scotch
Users that are interested in scotch are comparing it to the libraries listed below
Sorting:
- Going through a setting up a basic cheminformatics pipeline for the target EGFR☆19Apr 1, 2025Updated 10 months ago
- Code accompanying our blog post on a stronger docking baseline for Alpha Fold 3 docking☆21Jun 7, 2024Updated last year
- Materials for 2024☆13Dec 20, 2024Updated last year
- Layer Integrated Toolkit and Engine for Simulations of Photo-induced Phenomena☆10May 23, 2024Updated last year
- ☆11Nov 17, 2023Updated 2 years ago
- This repository gathers the NNAIMGUI code along with some instructions and readme files.☆11Mar 22, 2024Updated last year
- All the project files related to the development of an Arduino based autonomous mobile robot for UOM's EN2532 - Robot Design and Competit…☆11May 11, 2022Updated 3 years ago
- Automating the labelling of microstructure patterns in microscope images of welding joints☆11Jun 10, 2018Updated 7 years ago
- ☆10Jul 23, 2022Updated 3 years ago
- Computing the Committor with the Committor: an Anatomy of the Transition State Ensemble☆12Jul 12, 2024Updated last year
- Tools for geometric learning☆11Sep 26, 2025Updated 4 months ago
- ☆11Nov 3, 2023Updated 2 years ago
- Models trained on the SPICE dataset☆10Sep 23, 2022Updated 3 years ago
- Search for a model and corresponding hyperparameters that best model your data☆11Feb 3, 2026Updated last week
- Fast, hackable molecular integrals☆13Jan 20, 2026Updated 3 weeks ago
- LAST: Latent Space Assisted Adaptive Sampling for Protein Trajectories☆13Dec 17, 2022Updated 3 years ago
- Clases MAT281 - Segundo Semestre (UTSFM)☆41Nov 7, 2025Updated 3 months ago
- FoKL-GP implements Karhunen-Loève decomposed Gaussian processes with built-in forward variable selection. Decomposed GPs are key to embed…☆18Dec 6, 2025Updated 2 months ago
- CArbohydrate-Protein Site IdentiFier☆14Aug 22, 2023Updated 2 years ago
- A boilerplate for seamlessly integrating PyTorch's Distributed Data Parallel (DDP) with SLURM job scheduling and Weights and Biases. Kick…☆10Aug 21, 2023Updated 2 years ago
- The Polaris datasets and benchmarks recipes☆12May 26, 2025Updated 8 months ago
- ☆13Dec 5, 2024Updated last year
- This repo contains code for creating a Birds Classifier and an API where the user can upload a birds image and gets the according species…☆12Sep 18, 2022Updated 3 years ago
- Object detection method that can simultaneously estimate the positions and depth of the objects from images☆11Feb 14, 2022Updated 4 years ago
- Codebase for controlling and managing the Acceleration Consortium (AC) Training Lab.☆16Jan 27, 2026Updated 2 weeks ago
- Code for calculating grouped representation of interatomic distances (GRID) from crystal structures, and applying this in machine learnin…☆12Jun 22, 2023Updated 2 years ago
- ICD-10 nternational Statistical Classification of Diseases and Related Health Problems - Ground Truth and some Experimental R Code for N…☆14May 14, 2018Updated 7 years ago
- Building a choose-your-own-adventure story generator using the GTP-3 API☆10Aug 15, 2020Updated 5 years ago
- ☆10Jul 6, 2023Updated 2 years ago
- Graph-building for AtomicGraphNets☆12Nov 20, 2023Updated 2 years ago
- Julia implementation of algorithm for counting primitive rings in an atomistic structure. Useful for materials simulations☆16Nov 28, 2023Updated 2 years ago
- Base machine learning image and environment.☆16Feb 4, 2026Updated last week
- ☆21Jan 1, 2026Updated last month
- Developing efficient Bayesian phylogenetic inference methods☆12Dec 21, 2019Updated 6 years ago
- Plots for "Machine-learned and codified synthesis parameters of oxide materials" in the journal Scientific Data☆14Jul 6, 2017Updated 8 years ago
- LSTMs (Long Short Term Memory) RNN for prediction of price trends☆12Oct 31, 2021Updated 4 years ago
- Batch Calculator for Zeolite synthesis☆11Dec 14, 2024Updated last year
- JupyterHub deployment for ENGR101 Winter 2018 at Portland Community College☆11Dec 8, 2022Updated 3 years ago
- ☆22Dec 19, 2025Updated last month