microsoft / LLM4ScientificDiscovery
Call for participation in the impact of LLM for scientific discovery
☆63Updated 9 months ago
Alternatives and similar repositories for LLM4ScientificDiscovery:
Users that are interested in LLM4ScientificDiscovery are comparing it to the libraries listed below
- What can Large Language Models do in chemistry? A comprehensive benchmark on eight tasks☆135Updated 6 months ago
- Large language models to generate stable crystals.☆96Updated 7 months ago
- ☆42Updated 9 months ago
- BioT5 (EMNLP 2023) and BioT5+ (ACL 2024 Findings)☆102Updated 4 months ago
- Official code repo for the paper "LlaSMol: Advancing Large Language Models for Chemistry with a Large-Scale, Comprehensive, High-Quality …☆76Updated 2 months ago
- Code for "Unifying Molecular and Textual Representations via Multi-task Language Modelling" @ ICML 2023☆36Updated 4 months ago
- ☆34Updated 3 months ago
- ☆49Updated 8 months ago
- AI for Science☆87Updated 9 months ago
- List the AI for Science papers accepted by top conferences☆92Updated 4 months ago
- [ICLR 2024] MARCEL: Machine Learning over Molecular Conformer Ensembles☆40Updated last year
- ☆16Updated 7 months ago
- [ICLR 2022] Data-Efficient Graph Grammar Learning for Molecular Generation☆95Updated last year
- A new retrieval-based framework for controllable molecule generation.☆47Updated last year
- ICML2024: Equivariant Graph Neural Operator for Modeling 3D Dynamics☆51Updated 10 months ago
- Source code of MOLLEO☆34Updated 7 months ago
- Geom3D: Geometric Modeling on 3D Structures, NeurIPS 2023☆117Updated 7 months ago
- How good are LLMs at chemistry?☆55Updated this week
- A comprehensive repository dedicated to the collection and exploration of studies utilizing Large Language Models for molecular design, p…☆39Updated last year
- ChemReasoner - Catalyst Discovery via Large Language Model-driven Reasoning☆38Updated 3 weeks ago
- ☆197Updated 2 weeks ago
- BayesOpt + LIFT☆66Updated 3 months ago
- Mixed continous/categorical flow-matching model for de novo molecule generation.☆89Updated last week
- Code for the paper Enhancing Activity Prediction Models in Drug Discovery with the Ability to Understand Human Language☆95Updated 4 months ago
- InstructMol: Multi-Modal Integration for Building a Versatile and Reliable Molecular Assistant in Drug Discovery (COLING 2025)☆43Updated last month
- ☆77Updated 10 months ago
- This Denoising Force Field (DFF) codebase provides a Pytorch framework for the method presented in Two for one: Diffusion models and forc…☆53Updated 8 months ago
- ☆13Updated last year
- The OGB-LSC is the Large Scale Competition by Open Graph Benchmark to help accelerate research into machine learning on graph structured …☆71Updated 6 months ago
- SciAssess is a comprehensive benchmark for evaluating Large Language Models' proficiency in scientific literature analysis across various…☆68Updated 3 months ago