☆69Jun 27, 2025Updated last year
Alternatives and similar repositories for synflownet-boltz
Users that are interested in synflownet-boltz are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- A GFlowNet with a chemical synthesis action space.☆135Jan 31, 2025Updated last year
- SE(3)-equivariant point cloud networks for virtual screening☆11Nov 1, 2022Updated 4 years ago
- Enables using Boltz-1/1x to predict the structure of arbitrary covalent modifications / Non-Canonical Amino Acids. Covalent bonds are enf…☆22May 21, 2025Updated last year
- Boltzina: Efficient and Accurate Virtual Screening via Docking-Guided Binding Prediction with Boltz-2☆106May 16, 2026Updated 5 months ago
- Tool repository for CAR-PNN☆14Oct 7, 2026Updated 3 weeks ago
- Simple, predictable pricing with DigitalOcean hosting • AdAlways know what you'll pay with monthly caps and flat pricing. Enterprise-grade infrastructure trusted by 600k+ customers.
- ☆21Dec 5, 2024Updated last year
- Protein Engineering via Exploration of an Energy Landscape☆148Updated this week
- Accelerating Open-Source Binding Affinity Predictions☆201Aug 22, 2026Updated 2 months ago
- ☆164Sep 24, 2026Updated last month
- ☆20Oct 21, 2026Updated last week
- A Multi-Task Generative model for Structure-Based Drug Design☆72Oct 12, 2026Updated 3 weeks ago
- Synthesizable 3D Molecule Generation via Joint Reaction and Coordinate Modeling☆33Oct 13, 2026Updated 2 weeks ago
- FoldBench is a low-homology benchmark spanning proteins, nucleic acids, ligands, and six major interaction types, enabling assessments th…☆159May 9, 2026Updated 5 months ago
- Composing Unbalanced Flows for Flexible Docking and Relaxation (ICLR 2025)☆57Jun 19, 2025Updated last year
- 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.
- Coarse-grained and Multi-dimensional Data-driven molecular generation (CMD-GEN). This framework bridges three-dimensional ligand-protein …☆18Sep 13, 2025Updated last year
- ☆33Jul 27, 2026Updated 3 months ago
- Generates and scores synthetically tractable elaborations from fragment screens☆45Oct 14, 2026Updated 2 weeks ago
- A lightweight, fast pocket finder in Python.☆94Jul 22, 2026Updated 3 months ago
- BoltzGen: Toward Universal Binder Design☆1,093Updated this week
- ShEPhERD-2 code: Interaction Profiles as a Universal Language for Generative Molecular Design☆64Oct 23, 2026Updated last week
- Official repository of Zatom-1, a general-purpose model for 3D molecules and materials☆55Jul 25, 2026Updated 3 months ago
- A snakemake-based workflow for FEP and MM(PB/GB)SA calculations with GROMACS☆169May 9, 2026Updated 5 months ago
- An automated scoring function to facilitate and standardize the evaluation of goal-directed generative models for de novo molecular desig…☆245Apr 21, 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.
- Neural Iterative Selection-Expansion using LigandMPNN/LASErMPNN and Boltz-2x☆76Aug 11, 2026Updated 2 months ago
- ☆30Jul 29, 2026Updated 3 months ago
- ☆48Jul 13, 2025Updated last year
- ☆261Sep 22, 2026Updated last month
- GPU-accelerated (CUDA) contact molecular surface (CMS) and Lawrence & Colman shape complementarity (SC) for protein design☆32Sep 26, 2026Updated last month
- A fully open source biomolecular structure prediction model based on AlphaFold3☆909Updated this week
- ☆33Apr 16, 2026Updated 6 months ago
- 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
- ☆61May 9, 2025Updated 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.
- ☆90Feb 17, 2026Updated 8 months ago
- Metadiffusion implemented in Boltz-2☆25Feb 23, 2026Updated 8 months ago
- Structure-based fragment identification in latent space☆32Mar 4, 2026Updated 7 months ago
- Interaction Fingerprints for protein-ligand complexes and more☆554Updated this week
- A high-performance, GPU-accelerated library for key computational chemistry tasks, such as molecular similarity, conformer generation, an…☆281Oct 26, 2026Updated last week
- composite-objective protein design☆380Updated this week
- Plausibility checks for generated molecule poses.☆418Oct 3, 2026Updated 3 weeks ago