RetroBridge: Markov Bridge Model for Retrosynthesis Planning
☆34Mar 26, 2024Updated 2 years ago
Alternatives and similar repositories for RetroBridge
Users that are interested in RetroBridge are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- [NeurIPS 2024] "NovoBench: Benchmarking Deep Learning-based \emph{De Novo} Sequencing Methods in Proteomics"☆13Nov 23, 2024Updated last year
- ☆22Aug 1, 2023Updated 2 years ago
- Diffusion model for transition state prediction☆46Nov 30, 2023Updated 2 years ago
- [ICLR 2024] Domain-Agnostic Molecular Generation with Chemical Feedback☆190Dec 17, 2024Updated last year
- The official implementation of the paper "MotifRetro: Exploring the Combinability-Consistency Trade-offs in retrosynthesis via Dynamic Mo…☆11Jun 25, 2023Updated 2 years ago
- 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.
- The official code for PDVN: Retrosynthetic Planning with Dual Value Networks (ICML 2023)☆32Apr 21, 2024Updated last year
- B-cell Hybrid Immune Variant Engine☆12Updated this week
- Package for Retrosynthetic Planning☆192Apr 1, 2026Updated last week
- Code for the paper "NovoMolGen: Rethinking Molecular Language Model Pretraining"☆25Jan 18, 2026Updated 2 months ago
- ☆17Feb 5, 2024Updated 2 years ago
- Curated list on Deep Transformers Applications on Biology and Chemistry☆19Apr 8, 2023Updated 3 years ago
- Library of models for Protein Function prediction (part of the 18th top solution out of 1625 teams in CAFA5)☆20May 23, 2025Updated 10 months ago
- ☆19Jan 20, 2023Updated 3 years ago
- ☆22Jul 25, 2024Updated last year
- 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.
- Predicting MS1 precursor chemical formula from MS/MS data☆24Sep 20, 2023Updated 2 years ago
- Aligned Diffusion Schroedinger Bridges (UAI 2023)☆14Sep 18, 2025Updated 6 months ago
- Code implementation for the paper "Large-scale Pre-training for Grounded Video Caption Generation" (ICCV 2025)☆30Jan 18, 2026Updated 2 months ago
- Multi-Step Retrosynthesis Tool based on Augmented Disconnection Aware Triple Transformer Loop Predictions☆27Jul 2, 2024Updated last year
- Code for the paper "Learning to engineer protein flexibility".☆23Mar 24, 2026Updated 2 weeks ago
- Paper collection about de novo peptide Sequening☆23Feb 5, 2025Updated last year
- Mixed continous/categorical flow-matching model for de novo molecule generation.☆191Mar 21, 2026Updated 3 weeks ago
- ReTReK: data-driven ReTrosynthesis planning application using Retrosynthesis Knowledge☆35Jul 12, 2023Updated 2 years ago
- Synthesis-oriented GFlowNets on a large action space: "Generative Flows on Synthetic Pathway for Drug Design" (ICLR 2025)☆33Updated this week
- Managed hosting for WordPress and PHP on Cloudways • AdManaged hosting with the flexibility to host WordPress, Magento, Laravel, or PHP apps, on multiple cloud providers. Cloudways by DigitalOcean.
- Codebase of the paper "Str2Str: A Score-based Framework for Zero-shot Protein Conformation Sampling" (ICLR 2024)☆81Mar 7, 2024Updated 2 years ago
- Awesome papers and codes list of small molecule mass spectrometry-related machine learning methods☆36Jan 18, 2026Updated 2 months ago
- Official code repository for the paper READRetro: Natural Product Biosynthesis Planning with Retrieval-Augmented Dual-View Retrosynthesis☆22Jun 8, 2024Updated last year
- A collection of software for protein structure prediction and design☆41Dec 16, 2024Updated last year
- An object-aware diffusion model for generating chemical reactions☆145May 29, 2024Updated last year
- Precise reaction atom-to-atom mapping with LocalMapper☆47Jan 27, 2026Updated 2 months ago
- SMARTS sanitization☆32Mar 2, 2026Updated last month
- Diffusion-based molecule conformer generation☆46Apr 22, 2024Updated last year
- QGFN: Controllable Greediness with Action Values - Code☆11May 17, 2024Updated last year
- Managed hosting for WordPress and PHP on Cloudways • AdManaged hosting with the flexibility to host WordPress, Magento, Laravel, or PHP apps, on multiple cloud providers. Cloudways by DigitalOcean.
- The official PyTorch implementation of Manifold Preserving Guided Diffusion (MPGD)☆39Apr 16, 2024Updated last year
- A thin wrapper around ProteinMPNN for convenient sampling without having to write out or consume files☆13Apr 29, 2024Updated last year
- ☆33Jul 19, 2024Updated last year
- Geometric Latent Diffusion Models for 3D Molecule Generation☆275Jun 9, 2023Updated 2 years ago
- Cheminformatics tool that extends the decomposition of molecules into Bemis-Murcko frameworks.☆53Mar 10, 2025Updated last year
- GNEprop is a graph neural network-based model to predict antibacterial activity from molecular structures in virtual screening settings.☆42Oct 30, 2025Updated 5 months ago
- Retrosynthesis Prediction with an Iterative String Editing Model☆30Dec 27, 2024Updated last year