Lv7
4840 积分 2021-08-26 加入
Deep Learning vs Classical Methods in Potency & ADME Prediction: Insights from a Computational Blind Challenge
12天前
已完结
ExtractPDF: A data extraction tool for scientific papers applied to a systematic scoping review in public health
17天前
已关闭
Accelerated Chemical Space Generation of High Molar Extinction Organic Sensitizers via Machine Learning
20天前
已完结
A machine-learning tool to predict substrate-adaptive conditions for Pd-catalyzed C–N couplings
20天前
已完结
Accurately Predicting Solubility Curves via a Thermodynamic Cycle, Machine Learning, and Solvent Ensembles
20天前
已完结
Advances in small molecule representations and AI-driven drug research: bridging the gap between theory and application
20天前
已完结
FEP-SPell-ABFE: An Open-Source Automated Alchemical Absolute Binding Free-Energy Calculation Workflow for Drug Discovery
20天前
已完结
Knowledge-enhanced Relation Graph and Task Sampling for few-shot molecular property prediction
25天前
已完结
Combining quantum chemistry, machine learning and rate theory for organic luminescent materials
25天前
已完结
Overcoming Small Data Limitations in Materials Informatics: Interpretable Predictive Modeling of Optical Limiting Efficiency Using the CORRELATO Algorithm
27天前
已完结