activity
20192025
most citedReinforced Genetic Algorithm for Structure-based Drug Design

28 citations · 61 across the 5 of their papers we have counts for

collaborators

8 papers

cs.LG20252 cited

FinLoRA: Finetuning Quantized Financial Large Language Models Using Low-Rank Adaptation

Dannong Wang, Daniel Kim, Bo Jin +4

Finetuned large language models (LLMs) have shown remarkable performance in financial tasks, such as sentiment analysis and information retrieval. Due to privacy concerns, finetuni…

cs.LG20241 cited

Protein-Mamba: Biological Mamba Models for Protein Function Prediction

Bohao Xu, Yingzhou Lu, Yoshitaka Inoue +3

Protein function prediction is a pivotal task in drug discovery, significantly impacting the development of effective and safe therapeutics. Traditional machine learning models oft…

q-bio.QM202228 cited

Reinforced Genetic Algorithm for Structure-based Drug Design

Tianfan Fu, Wenhao Gao, Connor W. Coley +1

Structure-based drug design (SBDD) aims to discover drug candidates by finding molecules (ligands) that bind tightly to a disease-related protein (targets), which is the primary ap…

cs.LG202227 cited

MolGenSurvey: A Systematic Survey in Machine Learning Models for Molecule Design

Yuanqi Du, Tianfan Fu, Jimeng Sun +1

Molecule design is a fundamental problem in molecular science and has critical applications in a variety of areas, such as drug discovery, material science, etc. However, due to th…

cs.LG2021

Therapeutics Data Commons: Machine Learning Datasets and Tasks for Drug Discovery and Development

Kexin Huang, Tianfan Fu, Wenhao Gao +7

Therapeutics machine learning is an emerging field with incredible opportunities for innovatiaon and impact. However, advancement in this field requires formulation of meaningful l…

q-bio.QM2020

MolDesigner: Interactive Design of Efficacious Drugs with Deep Learning

Kexin Huang, Tianfan Fu, Dawood Khan +7

The efficacy of a drug depends on its binding affinity to the therapeutic target and pharmacokinetics. Deep learning (DL) has demonstrated remarkable progress in predicting drug ef…