Code for the paper Enhancing Activity Prediction Models in Drug Discovery with the Ability to Understand Human Language
☆114Feb 26, 2026Updated 3 months ago
Alternatives and similar repositories for clamp
Users that are interested in clamp are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Multi-modal Molecule Structure-text Model for Text-based Editing and Retrieval, Nat Mach Intell 2023 (https://www.nature.com/articles/s42…☆257Jun 27, 2025Updated 11 months ago
- PairMap: An Intermediate Insertion Approach for Improving the Accuracy of Relative Free Energy Perturbation Calculations for Distant Comp…☆17Mar 18, 2026Updated 2 months ago
- HyperPCM: Robust task-conditioned modeling of drug-target interactions☆38Oct 1, 2024Updated last year
- [ICLR 2024] Mol-Instructions: A Large-Scale Biomolecular Instruction Dataset for Large Language Models☆293Oct 28, 2024Updated last year
- Associated Repository for "Translation between Molecules and Natural Language"☆194Sep 15, 2023Updated 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.
- This is an updated version of the MolecularTransformer of Schwaller et. al.☆13Jan 17, 2022Updated 4 years ago
- Tree-Invent: A novel molecular generative model constrained with topological tree☆14Jul 26, 2023Updated 2 years ago
- Predictive Chemistry Augmented with Text Retrieval☆26Feb 20, 2024Updated 2 years ago
- The code for GIMLET: A Unified Graph-Text Model for Instruction-Based Molecule Zero-Shot Learning☆66Feb 22, 2024Updated 2 years ago
- ☆19Sep 4, 2025Updated 8 months ago
- BioT5 (EMNLP 2023) and BioT5+ (ACL 2024 Findings)☆126Sep 14, 2024Updated last year
- ☆15Jun 8, 2022Updated 3 years ago
- ☆31Nov 15, 2022Updated 3 years ago
- IBM Molecule Generation Experience (MolGX) is a tool to accelerate an AI-driven design of new materials.☆15Oct 26, 2022Updated 3 years ago
- Proton VPN Special Offer - Get 70% off • AdSpecial partner offer. Trusted by over 100 million users worldwide. Tested, Approved and Recommended by Experts.
- Dashboard for LLM Drug Discovery Challenge.☆14Sep 6, 2023Updated 2 years ago
- ☆259May 17, 2024Updated 2 years ago
- molfeat - the hub for all your molecular featurizers☆226May 27, 2025Updated last year
- FS-Mol is A Few-Shot Learning Dataset of Molecules, containing molecular compounds with measurements of activity against a variety of pr…☆175Feb 3, 2023Updated 3 years ago
- Another Molecular String Representation☆10May 8, 2026Updated 2 weeks ago
- Quantification of Uncertainty with Adversarial Models☆29Jul 11, 2023Updated 2 years ago
- Extracting medicinal chemistry intuition via preference machine learning☆119Oct 31, 2023Updated 2 years ago
- ☆69May 11, 2022Updated 4 years ago
- Downloads USPTO patents and finds molecules related to keyword queries☆72Dec 8, 2023Updated 2 years ago
- Managed Database hosting by DigitalOcean • AdPostgreSQL, MySQL, MongoDB, Kafka, Valkey, and OpenSearch available. Automatically scale up storage and focus on building your apps.
- ☆13Oct 9, 2024Updated last year
- Multimodal encoder-only transformer model for image-based protein predictions☆15Dec 12, 2023Updated 2 years ago
- Interactive molecule viewer for 2D structures☆254Dec 27, 2025Updated 4 months ago
- A new retrieval-based framework for controllable molecule generation.☆51Apr 22, 2023Updated 3 years ago
- ChemNLP project☆175May 18, 2026Updated last week
- A tool for evaluating the predictive performance on activity cliff compounds of machine learning models☆210Feb 15, 2025Updated last year
- ☆10Dec 20, 2023Updated 2 years ago
- A quantitative benchmark and analysis of molecular large language models.☆19Jun 3, 2025Updated 11 months ago
- ☆16Jun 16, 2022Updated 3 years ago
- GPU virtual machines on DigitalOcean Gradient AI • AdGet to production fast with high-performance AMD and NVIDIA GPUs you can spin up in seconds. The definition of operational simplicity.
- Enhanced Thompson Sampling☆12Apr 14, 2025Updated last year
- Synthesis generative model☆47Apr 24, 2025Updated last year
- ☆14Apr 16, 2024Updated 2 years ago
- ☆29Jan 16, 2026Updated 4 months ago
- Repository of Jupyter Notebooks on Colab, Binder and Huggingface for Bio, Chemistry and Physics☆13Jul 29, 2023Updated 2 years ago
- ☆57Nov 5, 2024Updated last year
- Official Repository for the Uni-Mol Series Methods☆1,105May 29, 2025Updated 11 months ago