Yuqiang Han's starred repositories
LLM-Planning-Papers
Must-read Papers on Large Language Model (LLM) Planning.
awesome-docking
An awesome & curated list of docking papers
ml-visuals
🎨 ML Visuals contains figures and templates which you can reuse and customize to improve your scientific writing.
Multimodal-AND-Large-Language-Models
Paper list about multimodal and large language models, only used to record papers I read in the daily arxiv for personal needs.
syntheseus
Package for Retrosynthetic Planning
tree-of-thoughts
Plug in and Play Implementation of Tree of Thoughts: Deliberate Problem Solving with Large Language Models that Elevates Model Reasoning by atleast 70%
Awesome-LLM-Uncertainty-Reliability-Robustness
Awesome-LLM-Robustness: a curated list of Uncertainty, Reliability and Robustness in Large Language Models
ChemLLMBench
What can Large Language Models do in chemistry? A comprehensive benchmark on eight tasks
bio_orthogonal_click_reactions
The code and data associated to the project on screening for new bio-orthogonal click reactions
atom-in-SMILES
Atom-in-SMILES tokenizer for SMILES strings.