Fork of DiffDock designed for fine tuning.
☆13Oct 26, 2025Updated 11 months ago
Alternatives and similar repositories for DiffDock-Fine-Tune
Users that are interested in DiffDock-Fine-Tune are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Trias: an encoder-decoder model for generating synthetic eukaryotic mRNA sequences☆14Apr 28, 2026Updated 5 months ago
- Open-source Deep Learning Framework for Allosteric Pocket Prediction☆17Jul 31, 2026Updated 2 months ago
- 📈 Uptime monitor and status page for Suliman Sharif, powered by @upptime☆19Updated this week
- ☆12Jan 28, 2024Updated 2 years ago
- ☆13Mar 9, 2026Updated 7 months 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.
- VenomPred 2.0 API☆11Jul 7, 2026Updated 3 months ago
- Open Source Deep Docking protocol (optimized)☆12Mar 19, 2026Updated 7 months ago
- Tree-Invent: A novel molecular generative model constrained with topological tree☆14Jul 26, 2023Updated 3 years ago
- ☆11May 25, 2026Updated 4 months ago
- Structure-based drug design based on Retrieval Augmented Generation☆29Nov 7, 2025Updated 11 months ago
- Official repo for paper "AlphaFold-Multimer accurately captures interactions and dynamics of intrinsically disordered protein regions"☆17Dec 8, 2024Updated last year
- Software for automated molecular dynamics simulation☆30Mar 5, 2026Updated 7 months ago
- ☆53Sep 24, 2025Updated last year
- Virtual screening approach for fragments selection and merging to lead-like compounds☆13Aug 20, 2021Updated 5 years ago
- Deploy to Railway using AI coding agents - Free Credits Offer • AdUse Claude Code, Codex, OpenCode, and more. Autonomous software development now has the infrastructure to match with Railway.
- ☆10Jul 30, 2024Updated 2 years ago
- ARCHIVED legacy compatibility bridge. Active development continues at SergeiNikolenko/Burette.☆21Sep 11, 2026Updated last month
- ☆12Oct 9, 2024Updated 2 years ago
- ☆89Sep 30, 2026Updated 3 weeks ago
- Sort & Slice: A Simple and Superior Alternative to Hash-Based Folding for Extended-Connectivity Fingerprints (ECFPs)☆10Feb 13, 2025Updated last year
- Virtual Medicinal Chemist, SAR reasoning☆43Jun 9, 2026Updated 4 months ago
- Compressed Graph Representation for Scalable Molecular Graph Generation☆11Sep 24, 2020Updated 6 years ago
- Open-source SBDD toolkit for standardized import of binding poses, restrained OpenMM minimization, pose QC, protein-ligand interaction an…☆23Sep 11, 2026Updated last month
- PackDock: a Diffusion Based Side Chain Packing Model for Flexible Protein-Ligand Docking☆65Mar 30, 2026Updated 6 months ago
- End-to-end encrypted email - Proton Mail • AdSpecial offer: 40% Off Yearly / 80% Off First Month. All Proton services are open source and independently audited for security.
- TarPass, a benchmark for target-aware de novo molecular generation.☆16Sep 23, 2026Updated last month
- PairMap: An Intermediate Insertion Approach for Improving the Accuracy of Relative Free Energy Perturbation Calculations for Distant Comp…☆17Mar 18, 2026Updated 7 months ago
- Reproducible cleaning and standardization of SMILES-based chemical datasets☆23Apr 15, 2026Updated 6 months ago
- Identifying amino acids important to AlphaFold!☆11Updated this week
- Merging, linking and placing compounds by stitching bound compounds together like a reanimated corpse☆12Feb 22, 2024Updated 2 years ago
- ☆14Jan 30, 2025Updated last year
- A comprehensive tool that automates the extraction of global and local cDFT descriptors using Multiwfn.☆19Mar 24, 2026Updated 6 months ago
- GatorAffinity: Boosting Protein-Ligand Binding Affinity Prediction with Large-Scale Synthetic Structural Data☆36Apr 10, 2026Updated 6 months ago
- ☆35Sep 3, 2026Updated last month
- 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.
- ☆18Apr 17, 2025Updated last year
- ☆16Aug 8, 2025Updated last year
- ☆16Sep 19, 2024Updated 2 years ago
- init commit☆16Oct 31, 2023Updated 2 years ago
- ☆40Feb 20, 2026Updated 8 months ago
- simple ML tool☆14Jul 9, 2024Updated 2 years ago
- ☆32May 25, 2026Updated 4 months ago