☆46Dec 30, 2025Updated 9 months ago
Alternatives and similar repositories for libraryPDB
Users that are interested in libraryPDB are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- ☆52Jun 15, 2026Updated 3 months ago
- Fast protein backbone flexibility prediction model☆41Sep 9, 2026Updated last month
- PyRosetta4 v2026-02-06 with (Global Interpreter Lock) disabled☆20Mar 22, 2026Updated 6 months ago
- Repository for Q and Q-FEP modules☆27Oct 6, 2026Updated last week
- A simple app to generate a predictive ML model from any ChEMBL target via UniprotID☆18Apr 24, 2026Updated 5 months 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.
- ☆58May 26, 2026Updated 4 months ago
- Automated, modular pipeline for de novo protein binder design on SLURM clusters, with the BFmonitor dashboard☆66Sep 23, 2026Updated 2 weeks ago
- Community-contributed extensions to the Chemprop machine learning package☆21Updated this week
- LillyMol Public Code☆18Updated this week
- A snakemake-based workflow for FEP and MM(PB/GB)SA calculations with GROMACS☆168May 9, 2026Updated 5 months ago
- DrugHIVE: Structure-based drug design with a deep hierarchical generative model☆115Oct 31, 2024Updated last year
- A Multi-Task Generative model for Structure-Based Drug Design☆71Sep 28, 2026Updated 2 weeks ago
- design by evolutionary algorithm☆23Aug 23, 2026Updated last month
- P2DFlow: A Protein Ensemble Generative Model with SE(3) Flow Matching☆46May 22, 2025Updated last year
- GPUs on demand by Runpod - Special Offer Available • AdRun AI, ML, and HPC workloads on powerful cloud GPUs—without limits or wasted spend. Deploy GPUs in under a minute and pay by the second.
- Ligand-Protein Interaction Mapping☆94Aug 6, 2026Updated 2 months ago
- Quick mapping of Uniprot sequences to PDB structures☆36Apr 1, 2025Updated last year
- ☆78Aug 19, 2026Updated last month
- This repo contains the results data for Round 2 of EGFR Protein Design Competition.☆20Mar 18, 2025Updated last year
- Neural Iterative Selection-Expansion using LigandMPNN/LASErMPNN and Boltz-2x☆73Aug 11, 2026Updated 2 months ago
- A fine-tuned version of ProteinMPNN for generating stable cyclic peptide sequences☆52Jun 30, 2026Updated 3 months ago
- PyChem-Pro: 100% Python API, fast, flexible & programmable molecular viewer - 2D and 3D, molecular docking pose viewer, cheminformatics l…☆393Updated this week
- Snippets for common computer-aided drug design tasks☆10Oct 17, 2017Updated 8 years ago
- One protein is all you need (ICLR 2026)