Awesome list of the data and AI/ML related projects with direct Life Science Companies participation
☆39Sep 13, 2024Updated last year
Alternatives and similar repositories for awesome-ls-ventures
Users that are interested in awesome-ls-ventures are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- An implementation of Roger Sayle's smizip algorithm for short string compression, like SMILES strings☆13Feb 1, 2025Updated last year
- ☆29Mar 16, 2023Updated 3 years ago
- Merging, linking and placing compounds by stitching bound compounds together like a reanimated corpse☆12Feb 22, 2024Updated 2 years ago
- SPECTRA: Spectral framework for evaluation of biomedical AI models☆45May 28, 2026Updated 2 months ago
- Practical Cheminformatics Blog Posts☆73Feb 10, 2026Updated 6 months 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.
- ANNalog package☆24Jul 12, 2026Updated 3 weeks ago
- ☆13Nov 26, 2024Updated last year
- Gaslands vehicle builder. This is my learning Android development app.☆10Jul 1, 2026Updated last month
- Code for the combinatorial synthesis library variational auto-encoder (CSLVAE) as described in the paper, "An efficient graph generative …☆14Nov 17, 2023Updated 2 years ago
- ☆16Jan 2, 2024Updated 2 years ago
- Predict DNA assembly clone validity rates - powered by Kappa☆10Jul 24, 2020Updated 6 years ago
- ☆15Jan 22, 2023Updated 3 years ago
- ☆21Mar 27, 2021Updated 5 years ago
- ☆29Jan 16, 2026Updated 6 months 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.
- Equivariant Scalar Fields for Molecular Docking with Fast Fourier Transforms☆33Dec 8, 2023Updated 2 years ago
- DockStream: A Docking Wrapper to Enhance De Novo Molecular Design☆136Mar 16, 2023Updated 3 years ago
- using C# code to control Hamilton STAR/STARlet/STAR plus/STAR vantage☆12Jul 19, 2024Updated 2 years ago
- Dynamic pharmacophore modeling of molecular interactions☆44Apr 26, 2024Updated 2 years ago
- ☆31Oct 29, 2023Updated 2 years ago
- Collection of scripts that integrates docking, virtual screening, similarity and molecular modeling programs.☆32Jul 13, 2026Updated 3 weeks ago
- QM40 is a QMx type of dataset which includes 150K molecules optimized from B3LYP/6-31G(2df,p) level of theory in the Gaussian16 with QM p…☆24Mar 25, 2025Updated last year
- Materials for the course Machine Learning for Molecular Engineering (3/7/10/20.C01/C51)☆31May 14, 2026Updated 2 months ago
- SMILES reading benchmark☆16Aug 17, 2018Updated 7 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.
- Chemical Space Visualization☆21Mar 18, 2026Updated 4 months ago
- Some demo python code to read, visualise and re-broadcast information emitted from https://github.com/Sensebloom/OSCeleton☆16Feb 18, 2011Updated 15 years ago
- These files are meant to accompany "What are our models really telling us? A practical tutorial on avoiding common mistakes when buildin…☆13May 22, 2013Updated 13 years ago
- DiffDock implementation that adds support for HPC execution using Slurm and Singularity☆26May 22, 2025Updated last year
- Snippets for common computer-aided drug design tasks☆10Oct 17, 2017Updated 8 years ago
- A minimal molecular viewer written in Javascript☆27Mar 13, 2011Updated 15 years ago
- Independent evaluation set construction for trustworthy ML models in biochemistry☆15Jul 28, 2026Updated last week
- ☆31Feb 27, 2026Updated 5 months ago
- Source code and data repository for "Ensembles of knowledge graph embedding models improve predictions for drug discovery"☆20Jan 17, 2024Updated 2 years ago
- 1-Click AI Models by DigitalOcean Gradient • AdDeploy popular AI models on DigitalOcean Gradient GPU virtual machines with just a single click. Zero configuration with optimized deployments.
- Shows some of the ways molecule generation and optimization can go wrong☆17Jul 6, 2023Updated 3 years ago
- Sandboxed tools and JS runtime for AI agents☆18Jul 13, 2026Updated 3 weeks ago
- Implementation of Shape and Electrostatic similarity metric in deepFMPO.☆47Jan 27, 2022Updated 4 years ago
- An automated scoring function to facilitate and standardize the evaluation of goal-directed generative models for de novo molecular desig…☆242Apr 21, 2026Updated 3 months ago
- Automatic CHARMM-GUI browser interaction with Python☆20Mar 20, 2023Updated 3 years ago
- Scaffold decoration and fragment linking with chemical language models and RL☆28Mar 24, 2025Updated last year
- Matplotlib and scipy to fit Gaussian/Lorentzian curves to raw data☆11May 24, 2024Updated 2 years ago