Lv5
878 积分 2025-09-18 加入
Generative AI for navigating synthesizable chemical space
1个月前
已完结
SynLlama: Generating Synthesizable Molecules and Their Analogs with Large Language Models
1个月前
已完结
A generalized-template-based graph neural network for accurate organic reactivity prediction
1个月前
已完结
Large-scale chemical language representations capture molecular structure and properties
1个月前
已完结
Bridging the gap between chemical reaction pretraining and conditional molecule generation with a unified model
1个月前
已完结
Large language models to accelerate organic chemistry synthesis
1个月前
已完结
Reusability report: Assessment of reproducibility and applicability to external datasets for RXNGraphormer
1个月前
已完结
A unified pre-trained deep learning framework for cross-task reaction performance prediction and synthesis planning
1个月前
已完结
Site-selective boron doping in CoN4 single-atom catalysts for enhanced bifunctional ORR/OER: A DFT investigation
1个月前
已完结
B-doped CoN4-Based catalysts as efficient Electrocatalysts for ORR/OER/HER with low overpotentials: Density functional theory studies
1个月前
已完结
皖公网安备34019202002308
