☆16Jul 7, 2024Updated last year
Alternatives and similar repositories for frankenrocs
Users that are interested in frankenrocs are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- LillyMol Public Code☆17Updated this week
- ☆17Jul 30, 2024Updated last year
- Efficient Sampling of PROTAC-Induced Ternary Complexes☆13Jun 3, 2025Updated 11 months ago
- ☆59Feb 17, 2026Updated 3 months ago
- ☆18Dec 31, 2024Updated last year
- 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.
- CReM-dock: generation of chemically reasonable molecules guided by molecular docking☆31May 9, 2026Updated 2 weeks ago
- ☆22Apr 7, 2023Updated 3 years ago
- ☆14May 15, 2024Updated 2 years ago
- ☆21May 28, 2025Updated 11 months ago
- GNEprop is a graph neural network-based model to predict antibacterial activity from molecular structures in virtual screening settings.☆45Apr 8, 2026Updated last month
- ☆18Sep 14, 2022Updated 3 years ago
- ☆99Aug 23, 2024Updated last year
- Extended version of the Chemprop framework that allows the calculation of atomistic and molecular Jazzy/Kallisto features.☆16Jan 10, 2025Updated last year
- ☆19Dec 5, 2024Updated last year
- 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.
- Remove effects of truncated side-products from read count data of a DNA-encoded library.☆28May 4, 2020Updated 6 years ago
- Fast calculation of hydrogen-bond strengths and free energy of hydration of small molecules.☆115Dec 5, 2025Updated 5 months ago
- Workflow to clean up and fix structural problems in protein-ligand binding datasets☆79Mar 18, 2026Updated 2 months ago
- BitBIRCH clustering algorithm☆127Oct 21, 2025Updated 7 months ago
- Training and inference code for ShEPhERD: Diffusing shape, electrostatics, and pharmacophores for bioisosteric drug design [ICLR 2025 ora…☆93Mar 31, 2026Updated last month
- Repo for the publication titled: "Key Interaction Networks: Identifying Evolutionarily Conserved Non-Covalent Interaction Networks Across…☆18Nov 14, 2023Updated 2 years ago
- Deep Learning-based Bioisosteric Replacements for Optimization of Multiple Molecular Properties☆30May 13, 2026Updated last week
- Diffusion-based molecule conformer generation☆47Apr 22, 2024Updated 2 years ago
- ☆20Nov 12, 2024Updated last year
- 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.
- ☆27Jul 3, 2024Updated last year
- C++/Python Library for Systematic Chemical Space Exploration☆25Dec 21, 2021Updated 4 years ago
- ☆13Jul 11, 2023Updated 2 years ago
- Some useful RDKit functions☆228Apr 30, 2026Updated 3 weeks ago
- The backend services of the GenUI framework. The backend provides the REST API used for molecular generation, QSAR modelling and chemical…☆36Feb 3, 2026Updated 3 months ago
- A knowledge-based method for determining small molecule binding "hotspots".☆40May 3, 2024Updated 2 years ago
- Machine Learning model for molecular micro-pKa prediction☆51Sep 28, 2024Updated last year