This is the official code for MolReasoner: Toward Effective and Interpretable Reasoning for Molecular LLMs
☆46Aug 28, 2025Updated last year
Alternatives and similar repositories for MolReasoner
Users that are interested in MolReasoner are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- ☆55Oct 16, 2024Updated last year
- SciAssess is a comprehensive benchmark for evaluating Large Language Models' proficiency in scientific literature analysis across various…☆89May 21, 2025Updated last year
- [NeurIPS 24] Can LLMs Solve Molecule Puzzles? A Multimodal Benchmark for Molecular Structure Elucidation☆21Jan 2, 2026Updated 8 months ago
- an efficient distributed PyTorch framework☆164Jul 19, 2025Updated last year
- unimol_tools: a easy-use & auto-ml molecule property prediction tool☆34Jul 16, 2026Updated last month
- 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.
- [Nature npj Computational Materials] This is the official code for the paper “Virtual Characterization via Knowledge-Enhanced Representat…☆15Aug 17, 2026Updated 2 weeks ago
- [EMNLP 2023] ReLM: Leveraging Language Models for Enhanced Chemical Reaction Prediction.☆23Jan 28, 2024Updated 2 years ago
- [CIKM2024] The official implementation of "MMPolymer: A Multimodal Multitask Pretraining Framework for Polymer Property Prediction"☆39Aug 20, 2025Updated last year
- [ICML 2025] Hierarchical Graph Tokenization for Molecule-Language Alignment☆17Aug 18, 2025Updated last year
- [ACL 2024] ReactXT: Understanding Molecular “Reaction-ship” via Reaction-Contextualized Molecule-Text Pretraining. by Zhiyuan Liu*, Yaoru…☆31Sep 3, 2024Updated 2 years ago
- Source code for ICLR2025 paper "NExT-Mol: 3D Diffusion Meets 1D Language Modeling for 3D Molecule Generation".☆93Aug 23, 2025Updated last year
- Serializing molecule 3D structures☆14Nov 27, 2024Updated last year
- [CIKM2023] The official implementation of "MPerformer: An SE(3) Transformer-based Molecular Perceptron"☆27Nov 12, 2024Updated last year
- ☆17May 25, 2025Updated last year
- 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.
- ☆17Mar 9, 2026Updated 5 months ago
- The official implementation of “ReGuLaR: Variational Latent Reasoning Guided by Rendered Chain-of-Thought”☆54Feb 2, 2026Updated 7 months ago
- InstructMol: Multi-Modal Integration for Building a Versatile and Reliable Molecular Assistant in Drug Discovery (COLING 2025)☆54Dec 2, 2024Updated last year
- A PyTorch implementation of Uni-Mol3.☆24Mar 24, 2026Updated 5 months ago
- ☆13Apr 15, 2024Updated 2 years ago
- This repository contains information on the creation, evaluation, and benchmark models for the L+M-24 Dataset. L+M-24 will be featured as…☆30Jan 23, 2025Updated last year
- A Quasi-Wasserstein Loss for Learning Graph Neural Networks (QW loss)☆10May 20, 2024Updated 2 years ago
- Awesome list about AI4Polymer☆19Aug 19, 2026Updated 2 weeks ago
- Learnable Global Pooling Layers Based on Regularized Optimal Transport (ROT)☆16Mar 17, 2024Updated 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.
- Papers about Structure-based Drug Design (SBDD)☆153Sep 1, 2025Updated last year
- [ICML2025] The official implementation of "PolyConf: Unlocking Polymer Conformation Generation through Hierarchical Generative Models"☆37Mar 18, 2026Updated 5 months ago
- ☆64Mar 23, 2026Updated 5 months ago
- Conditional Diffusion Based on Discrete Graph Structures for Molecular Graph Generation☆39Jun 11, 2023Updated 3 years ago
- TED-GEN: a universal, efficient image generation framework for electron microscopy☆11May 7, 2025Updated last year
- Large language models, physics-based modeling, experimental measurements: the trinity of data-scarce learning of polymer properties☆14Sep 4, 2025Updated last year
- Unified machine learning model for predicting polymer properties through human language instructions☆35May 6, 2025Updated last year
- PRESTO: Progressive Pretraining Enhances Synthetic Chemistry Outcomes [EMNLP 2024]☆28Nov 18, 2024Updated last year
- The repository for the generative pretrained model on polymer generation☆22Mar 20, 2026Updated 5 months 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.
- [ACL 2024] ProtLLM: An Interleaved Protein-Language LLM with Protein-as-Word Pre-Training☆51Mar 14, 2024Updated 2 years ago
- ☆22May 7, 2025Updated last year
- Llamole: Multimodal Large Language Models for Inverse Molecular Design with Retrosynthetic Planning☆44Oct 10, 2024Updated last year
- Code for EMNLP2023 paper "MolCA: Molecular Graph-Language Modeling with Cross-Modal Projector and Uni-Modal Adapter".☆13Dec 27, 2023Updated 2 years ago
- A Python library for constructing polymer topologies and coordinates☆22Sep 23, 2025Updated 11 months ago
- Structured Chemistry Reasoning with Large Language Models☆42May 4, 2024Updated 2 years ago
- ☆17Feb 27, 2026Updated 6 months ago