Independent evaluation set construction for trustworthy ML models in biochemistry
☆15Oct 28, 2026Updated last week
Alternatives and similar repositories for Hestia-GOOD
Users that are interested in Hestia-GOOD are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Code for reproducing paper describing methods for representing peptides☆18Sep 11, 2026Updated last month
- AutoML system for building trustworthy peptide bioactivity predictors☆42Oct 25, 2026Updated last week
- ☆47Oct 19, 2026Updated 2 weeks ago
- Predicting cleaved peptides in protein sequences☆11Jul 3, 2024Updated 2 years ago
- FluxGAT introduces a graph neural network (GNN) model designed to predict gene essentiality by utilising graphical representations derive…☆11Mar 5, 2026Updated 8 months ago
- GPU virtual machines on DigitalOcean Gradient AI • AdGet to production fast with high-performance AMD and NVIDIA GPUs you can spin up in seconds. The definition of operational simplicity.
- ☆14Jun 5, 2024Updated 2 years ago
- Results and data from the pilot round of the Protein Engineering Tournament☆32Mar 25, 2025Updated last year
- Base image providing dependencies for ASKCOS Docker images☆12Jun 14, 2024Updated 2 years ago
- Code for Semi-relaxed Gromov-Wasserstein divergence with applications on graphs (ICLR 2022)☆10Mar 11, 2022Updated 4 years ago
- ☆11Sep 21, 2026Updated last month
- Build and deploy cross platform bioinformatic utilities with Rust.☆19Apr 1, 2025Updated last year
- FIRECODE: a computational chemistry workflow driver and modular hub☆23Aug 19, 2026Updated 2 months ago
- ☆15Nov 9, 2025Updated 11 months ago
- Repository for "Nearest neighbor search on embeddings rapidly identifies distant protein relations"☆13Apr 2, 2023Updated 3 years ago
- Deploy on Railway without the complexity - Free Credits Offer • AdConnect your repo and Railway handles the rest with instant previews. Quickly provision container image services, databases, and storage volumes.
- Residue Level Alignment☆22Nov 21, 2024Updated last year
- Repository of Jupyter Notebooks created by the Bio2Byte group☆10Apr 9, 2025Updated last year
- ☆11May 14, 2025Updated last year
- My solutions to the programming exercises from Stanford's Machine Learning online course☆12Dec 21, 2011Updated 14 years ago
- Open Source Deep Docking protocol (optimized)☆12Mar 19, 2026Updated 7 months ago
- The official repo for paper: Uncertainty Quantification and Interpretability for Clinical Trial Approval Prediction by Tianyi Chen, Nan H…☆10Feb 26, 2024Updated 2 years ago
- surrogate quantitative interpretability for deepnets☆27Aug 28, 2026Updated 2 months ago
- FuseMedML based molecular biochemistry library for drug discovery/repurposing☆26Mar 17, 2026Updated 7 months ago
- ☆13Oct 10, 2024Updated 2 years ago
- Wordpress hosting with auto-scaling - Free Trial Offer • AdFully Managed hosting for WordPress and WooCommerce businesses that need reliable, auto-scalable performance. Cloudways SafeUpdates now available.
- BioMetAll is a command line application to allow the identification of metal-binding sites in proteins from backbone preorganization.☆13Jun 9, 2026Updated 4 months ago
- Code and Data for Generative modeling for AAV design☆11Nov 13, 2023Updated 2 years ago
- ☆49Jun 18, 2024Updated 2 years ago
- ☆11Sep 28, 2026Updated last month
- A constraint-based method for prediction of metabolic engineering targets using ecModels of metabolism☆15Feb 12, 2025Updated last year
- Chemical Data Science and Engineering - University of Toronto☆31Oct 19, 2026Updated 2 weeks ago
- A set a basic Python scripts to edit a multiple sequence alignment and generate a protein consensus sequence☆21Jun 9, 2022Updated 4 years ago
- A deep learning framework (CreoPep) for target-specific design and optimization of conotoxin peptides☆17Mar 28, 2026Updated 7 months ago
- Drug Response Prediction and Biomarker Discovery Using Multi-Modal Deep Learning☆14Apr 24, 2024Updated 2 years ago
- AI Agents on DigitalOcean Gradient AI Platform • AdBuild production-ready AI agents using customizable tools or access multiple LLMs through a single endpoint. Create custom knowledge bases or connect external data.
- Scripts to perform active learning as described in the referenced article.☆14Sep 17, 2025Updated last year
- protein utilities in Rust☆33Updated this week
- Official implementation of NeurIPS'24 paper "Bridge-IF: Learning Inverse Protein Folding with Markov Bridges"☆18Mar 16, 2025Updated last year
- ☆15Apr 4, 2025Updated last year
- To use Evo2 easily☆26Apr 7, 2026Updated 7 months ago
- Code for Online Graph Dictionary Learning☆18Mar 1, 2022Updated 4 years ago
- ☆18Mar 26, 2024Updated 2 years ago