an efficient distributed PyTorch framework
☆163Jul 19, 2025Updated last year
Alternatives and similar repositories for Uni-Core
Users that are interested in Uni-Core are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Official Repository for the Uni-Mol Series Methods☆1,176May 29, 2025Updated last year
- This is the official code for MolReasoner: Toward Effective and Interpretable Reasoning for Molecular LLMs☆46Aug 28, 2025Updated last year
- SciAssess is a comprehensive benchmark for evaluating Large Language Models' proficiency in scientific literature analysis across various…☆88May 21, 2025Updated last year
- Implementation of paper "Uni-3DAR: Unified 3D Generation and Understanding via Autoregression on Compressed Spatial Tokens"☆158Apr 21, 2025Updated last year
- An open-source platform for developing protein models beyond AlphaFold.☆425Jun 26, 2024Updated 2 years ago
- Managed hosting for WordPress and PHP on Cloudways • AdManaged hosting for WordPress, Magento, Laravel, or PHP apps, on multiple cloud providers. Deploy in minutes on Cloudways by DigitalOcean.
- unimol_tools: a easy-use & auto-ml molecule property prediction tool☆36Jul 16, 2026Updated 3 months ago
- ☆14Aug 29, 2024Updated 2 years ago
- A PyTorch implementation of Uni-Mol3.☆24Mar 24, 2026Updated 7 months ago
- [Nature npj Computational Materials] This is the official code for the paper “Virtual Characterization via Knowledge-Enhanced Representat…☆16Aug 17, 2026Updated 2 months ago
- Uni-Dock: a GPU-accelerated molecular docking program☆315Jul 20, 2026Updated 3 months ago
- Pocket2Mol: Efficient Molecular Sampling Based on 3D Protein Pockets☆415Nov 16, 2023Updated 2 years ago
- The official implementation of "A Conformation-Centric Generative Foundation Model for Linear Polymer Modeling and Design"☆15May 9, 2026Updated 5 months ago
- ☆64Oct 25, 2022Updated 4 years ago
- ☆67Mar 23, 2026Updated 7 months ago
- Managed Database hosting by DigitalOcean • AdPostgreSQL, MySQL, MongoDB, Kafka, Valkey, and OpenSearch available. Automatically scale up storage and focus on building your apps.
- Binding Affinity Prediction using Deep learning models☆12Jun 9, 2021Updated 5 years ago
- The official implementation of 3D Equivariant Diffusion for Target-Aware Molecule Generation and Affinity Prediction (ICLR 2023)☆351Jan 10, 2024Updated 2 years ago
- 🧬 Fusion of protein sequence and structural information, using denoising pre-training network for zero-shot protein engineering (eLife 2…☆98Sep 29, 2026Updated last month
- Dock organometallic compounds to proteins/DNA/biomolecules☆23May 26, 2025Updated last year
- ☆12Jul 5, 2024Updated 2 years ago
- Toward High-Accuracy Open-Source Biomolecular Structure Prediction.☆2,102Sep 21, 2026Updated last month
- Token-Mol 1.0：tokenized drug design with large language model☆67Jun 1, 2026Updated 5 months ago
- [NeurIPS 24] Can LLMs Solve Molecule Puzzles? A Multimodal Benchmark for Molecular Structure Elucidation☆21Jan 2, 2026Updated 10 months ago
- A novel method that quantitatively evaluates the impact of PLM in PLI predictions.☆12Sep 14, 2023Updated 3 years 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.
- Official repository for MolCRAFT series☆160Oct 27, 2025Updated last year
- ☆56Oct 16, 2024Updated 2 years ago
- ☆17Jun 3, 2024Updated 2 years ago
- Implementation of GeoDiff: a Geometric Diffusion Model for Molecular Conformation Generation (ICLR 2022).☆421May 17, 2023Updated 3 years ago
- ☆28Jul 3, 2024Updated 2 years ago
- CovDocker: Benchmarking Covalent Drug Design with Tasks, Datasets, and Solutions (KDD'25 research track accepted)☆17Aug 6, 2025Updated last year
- ☆14Mar 7, 2024Updated 2 years ago
- The first large protein language model trained follows structure instructions.☆103May 20, 2025Updated last year
- SIU: A Million-Scale Structural Small Molecule-Protein Interaction Dataset for Unbiased Bioactivity Prediction☆17Feb 17, 2025Updated last year
- 1-Click AI Models by DigitalOcean Gradient • AdDeploy popular AI models on DigitalOcean Gradient GPU virtual machines with just a single click. Zero configuration with optimized deployments.
- TarPass, a benchmark for target-aware de novo molecular generation.☆16Sep 23, 2026Updated last month
- ☆21Aug 22, 2022Updated 4 years ago
- Official code repository of < CBGBench: Fill in the Blank of Protein-Molecule Complex Binding Graph >☆330Sep 14, 2025Updated last year
- Alchemd is a Python-based CADD (Computer-Aided Drug Design) application specialized in free energy perturbation (FEP) calculations using …☆11May 26, 2026Updated 5 months ago
- Codebase of paper "Structure Language Models for Protein Conformation Generation" (ICLR'25)☆87May 27, 2026Updated 5 months ago
- ☆15Dec 4, 2023Updated 2 years ago
- Codes for our paper "Full-Atom Peptide Design with Geometric Latent Diffusion" (NeurIPS 2024)☆134Apr 16, 2025Updated last year