Code for the paper Enhancing Activity Prediction Models in Drug Discovery with the Ability to Understand Human Language
☆109Feb 26, 2026Updated last week
Alternatives and similar repositories for clamp
Users that are interested in clamp are comparing it to the libraries listed below
Sorting:
- Multi-modal Molecule Structure-text Model for Text-based Editing and Retrieval, Nat Mach Intell 2023 (https://www.nature.com/articles/s42…☆251Jun 27, 2025Updated 8 months ago
- [ICLR 2024] Mol-Instructions: A Large-Scale Biomolecular Instruction Dataset for Large Language Models☆292Oct 28, 2024Updated last year
- This is an updated version of the MolecularTransformer of Schwaller et. al.☆14Jan 17, 2022Updated 4 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
- Associated Repository for "Translation between Molecules and Natural Language"☆192Sep 15, 2023Updated 2 years ago
- Predictive Chemistry Augmented with Text Retrieval☆24Feb 20, 2024Updated 2 years ago
- ☆19Sep 4, 2025Updated 6 months ago
- HyperPCM: Robust task-conditioned modeling of drug-target interactions☆38Oct 1, 2024Updated last year
- Tree-Invent: A novel molecular generative model constrained with topological tree☆13Jul 26, 2023Updated 2 years ago
- Large language models as universal biomedical simulators☆20Jul 17, 2024Updated last year
- Enhanced Thompson Sampling☆12Apr 14, 2025Updated 10 months ago
- Another Molecular String Representation☆10Feb 14, 2026Updated 2 weeks ago
- ☆10Nov 17, 2020Updated 5 years ago
- ☆10Dec 20, 2023Updated 2 years ago
- ☆13Oct 9, 2024Updated last year
- PairMap: An Intermediate Insertion Approach for Improving the Accuracy of Relative Free Energy Perturbation Calculations for Distant Comp…☆16Oct 23, 2025Updated 4 months ago
- A quantitative benchmark and analysis of molecular large language models.☆18Jun 3, 2025Updated 9 months ago
- The code for GIMLET: A Unified Graph-Text Model for Instruction-Based Molecule Zero-Shot Learning☆66Feb 22, 2024Updated 2 years ago
- ☆257May 17, 2024Updated last year
- InstructMol: Multi-Modal Integration for Building a Versatile and Reliable Molecular Assistant in Drug Discovery (COLING 2025)☆53Dec 2, 2024Updated last year
- Extracting medicinal chemistry intuition via preference machine learning☆117Oct 31, 2023Updated 2 years ago
- A comprehensive repository dedicated to the collection and exploration of studies utilizing Large Language Models for molecular design, p…☆45Aug 2, 2023Updated 2 years ago
- ☆14Apr 16, 2024Updated last year
- ChemNLP project☆172Updated this week
- BioT5 (EMNLP 2023) and BioT5+ (ACL 2024 Findings)☆123Sep 14, 2024Updated last year
- AI4Chem is a code to test the ability of large language models (ChatGPT) to comprehend Chemistry.☆23Aug 5, 2025Updated 7 months ago
- ☆31Nov 15, 2022Updated 3 years ago
- molfeat - the hub for all your molecular featurizers☆222May 27, 2025Updated 9 months ago
- FS-Mol is A Few-Shot Learning Dataset of Molecules, containing molecular compounds with measurements of activity against a variety of pr…☆172Feb 3, 2023Updated 3 years ago
- Repository for AAAI 2024 paper "From Artificially Real to Real: Leveraging Pseudo Data from Large Language Models for Low-Resource Molecu…☆23Dec 20, 2023Updated 2 years ago
- ☆24Jun 23, 2021Updated 4 years ago
- ☆15Jun 8, 2022Updated 3 years ago
- ☆52May 24, 2024Updated last year
- Dashboard for LLM Drug Discovery Challenge.☆14Sep 6, 2023Updated 2 years ago
- Code implementation for paper "Can Large Language Models Empower Molecular Property Prediction?"☆39Jul 14, 2023Updated 2 years ago
- ☆69May 11, 2022Updated 3 years ago
- Small molecules discovery with different active deep learning strategies. Codebase for the paper: "Traversing chemical space with active …☆28Aug 18, 2024Updated last year
- Synthesis-oriented GFlowNets on a large action space: "Generative Flows on Synthetic Pathway for Drug Design" (ICLR 2025)☆31Oct 23, 2025Updated 4 months ago
- ☆45Nov 20, 2025Updated 3 months ago