Michael G. Taylor - Publications, H-index & Citations

Michael G. Taylor

los alamos national laboratory

44H指数

240论文数

7.4K被引数

收录论文 38

发表时间

Meta-learning linear models for molecular property prediction 元学习线性模型用于分子性质预测

Digital Discovery

IF5.6

2026-05-14

OAAI

Yulia Pimonova; Michael G. Taylor; Alice Allen; Ping Yang; Nicholas Lubbers

Augmenting Large Language Models for Automated Discovery of F-Element Extractants 扩充大型语言模型以自动发现F元素萃取剂

Journal of the American Chemical Society

IF15.6

2026-01-28

PREAI

Baosen Zhang; Thomas J. Summers; Logan J. Augustine; Michael G. Taylor; Andreas Geist; Rebecca Li; Enrique R. Batista; Danny Perez; Ping Yang; Joshua Schrier

Application of quaternions to obtain analytic solutions to systems of polarization components 四元数在极化分量系统解析解中的应用

Optics Communications

IF2.5

2026-01-01

OAAI

Taylor, Michael G.

Hierarchical Attention Graph Learning with LLMs Enhancement for Molecular Solubility Prediction 基于LLMs增强的层次化注意力图学习用于分子溶解度预测

Digital Discovery

IF5.6

2025-12-16

OAAI

Yangxin Fan; Yinghui Wu; Roger French; Danny Perez; Michael Taylor; Ping Yang

Creation of the Separation Archive for Elements (SAFE) Database 创建元素分离档案（SAFE）数据库

SOLVENT EXTRACTION AND ION EXCHANGE

IF2.1

2025-09-01

PREAI

Leite, Leonardo da Silva Garcia; Zhang, Baosen; Acar, Zafer; Elowitt, Jackson; Augustine, Logan J.; Clark, Aurora E.; Karamalis, Victor; Perez, Danny; Schrier, Joshua; Taylor, Michael; Yang, Ping

MLTB: Enhancing Transferability and Extensibility of Density Functional Tight-Binding Theory with Many-body Interaction Corrections

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2025-01-29

OAAI

Burrill, Daniel J.; Liu, Chang; Taylor, Michael G.; Cawkwell, Marc J.; Perez, Danny; Batista, Enrique R.; Lubbers, Nicholas; Yang, Ping

Precursor reaction pathway leading to BiFeO3 formation: insights from text-mining and chemical reaction network analyses 前驱体反应路径导致BiFeO₃形成：文本挖掘和化学反应网络分析的见解

DIGITAL DISCOVERY

IF5.6

2025-01-01

OAAI

Baibakova, Viktoriia; Cruse, Kevin; Taylor, Michael G.; Sutter-Fella, Carolin M.; Ceder, Gerbrand; Jain, Anubhav; Blau, Samuel M.

On the Importance of Configuration Search to the Predictivity of Lanthanide Selectivity 关于构型搜索对镧系元素选择性预测的重要性

JACS AU

IF8.7

2024-11-18

OAAI

Summers, Thomas J.; Taylor, Michael G.; Augustine, Logan J.; Janssen, Jan; Perez, Danny; Batista, Enrique R.; Yang, Ping

Heterocyclic Modification Leading to Luminescent 0D Metal Organochalcogenide with Stable X-ray Scintillating Properties

CHEMISTRY OF MATERIALS

IF7

2024-05-07

PREAI

Khamlue, Rattapon; Sakurada, Tomoaki; Cho, Yeongsu; Lee, Woo Seok; Leangtanom, Pimpan; Taylor, Michael G.; Naewthong, Worakit; Sripetch, Pongsakun; Na Ranong, Busayakorn; Autila, Tossawat; Rungseesumran, Thiti; Kaewkhao, Jakrapong; Sudyoadsuk, Taweesak; Kopwitthaya, Atcha; Mueller, Peter; Promarak, Vinich; Kulik, Heather J.; Tisdale, William A.; Paritmongkol, Watcharaphol

Linear graphlet models for accurate and interpretable cheminformatics

DIGITAL DISCOVERY

IF5.6

2024-01-01

OAAI

Tynes, Michael; Taylor, Michael G.; Janssen, Jan; Burrill, Daniel J.; Perez, Danny; Yang, Ping; Lubbers, Nicholas

Architector for high-throughput cross-periodic table 3D complex building (vol 14, 2786, 2023)

NATURE COMMUNICATIONS

IF15.7

2023-10-04

OAAI

Taylor, Michael G.; Burrill, Daniel J.; Janssen, Jan; Batista, Enrique R.; Perez, Danny; Yang, Ping

Assessing the performance of approximate density functional theory on 95 experimentally characterized Fe(II) spin crossover complexes 在95个实验表征的Fe(II) 自旋交叉配合物上评估近似密度泛函理论的性能

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2023-07-11

OAAI

Vennelakanti, Vyshnavi; Taylor, Michael G.; Nandy, Aditya; Duan, Chenru; Kulik, Heather J.

Architector for high-throughput cross-periodic table 3D complex building

NATURE COMMUNICATIONS

IF15.7

2023-05-15

OAAI

Taylor, Michael G.; Burrill, Daniel J.; Janssen, Jan; Batista, Enrique R.; Perez, Danny; Yang, Ping

Ligand additivity relationships enable efficient exploration of transition metal chemical space 配体可加性关系可有效探索过渡金属化学空间

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2022-11-14

OAAI

Arunachalam, Naveen; Gugler, Stefan; Taylor, Michael G.; Duan, Chenru; Nandy, Aditya; Janet, Jon Paul; Meyer, Ralf; Oldenstaedt, Jonas; Chu, Daniel B. K.; Kulik, Heather J.

Exploiting Ligand Additivity for Transferable Machine Learning of Multireference Character across Known Transition Metal Complex Ligands 利用配体可加性在已知过渡金属配合物配体上进行多参考特征的可转移机器学习

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2022-07-14

OAAI

Duan, Chenru; Ladera, Adriana J.; Liu, Julian C. -L.; Taylor, Michael G.; Ariyarathna, Isuru R.; Kulik, Heather J.

Molecular orbital projectors in non-empirical jmDFT recover exact conditions in transition-metal chemistry 非经验jmDFT中的分子轨道投射器恢复了过渡金属化学中的精确条件

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2022-05-11

OAAI

Bajaj, Akash; Duan, Chenru; Nandy, Aditya; Taylor, Michael G.; Kulik, Heather J.

Large-Scale Screening Reveals That Geometric Structure Matters More Than Electronic Structure in the Bioinspired Catalyst Design of Formate Dehydrogenase Mimics 大规模筛选表明，在甲酸脱氢酶模拟物的生物启发催化剂设计中，几何结构比电子结构更重要

ACS CATALYSIS

IF13.1

2021-12-16

PREAI

Liu, Mingjie; Nazemi, Azadeh; Taylor, Michael G.; Nandy, Aditya; Duan, Chenru; Steeves, Adam H.; Kulik, Heather J.

Usability and value of a digital learning resource in nursing education across European countries: a cross-sectional exploration

BMC NURSING

IF3.9

2021-09-06

OAAI

Urstad, Kristin Hjorthaug; Navarro-Illana, Esther; Oftedal, Bjorg; Whittingham, Katharine; Alamar, Santiago; Windle, Richard; Lokken, Atle; Taylor, Michael; Larsen, Marie Hamilton; Narayasanamy, Melanie; Sancho-Pelluz, Javier; Navarro-Illana, Pedro; Wharrad, Heather

Mapping the Origins of Surface- and Chemistry-Dependent Doping Trends in III-V Quantum Dots with Density Functional Theory

CHEMISTRY OF MATERIALS

IF7

2021-09-02

PREAI

Taylor, Michael G.; Kulik, Heather J.

Solvent manipulation of the pre-reduction metal-ligand complex and particle-ligand binding for controlled synthesis of Pd nanoparticles

NANOSCALE

IF5.1

2021-01-01

OAAI

Li, Wenhui; Taylor, Michael G.; Bayerl, Dylan; Mozaffari, Saeed; Dixit, Mudit; Ivanov, Sergei; Seifert, Soenke; Lee, Byeongdu; Shanaiah, Narasimhamurthy; Lu, Yubing; Kovarik, Libor; Mpourmpakis, Giannis; Karim, Ayman M.

研究方向