日期:
2020 年 — 2026 年
2020
2021
2022
2023
2024
2025
2026
影响因子:

Open Molecular Crystals 2025 (OMC25) dataset and models

Open Molecular Crystals 2025 (OMC25) 数据集和模型

Gharakhanyan, Vahe; Barroso-Luque, Luis; Yang, Yi; Shuaibi, Muhammed; Michel, Kyle; Levine, Daniel S; Dzamba, Misko; Fu, Xiang; Gao, Meng; Liu, Xingyu; Ni, Haoran; Noori, Keian; Wood, Brandon M; Uyttendaele, Matt; Boromand, Arman; Zitnick, C Lawrence; Marom, Noa; Ulissi, Zachary W; Sriram, Anuroop

Application-driven design of non-aqueous electrolyte solutions through quantification of interfacial reactions in lithium metal batteries

通过量化锂金属电池中的界面反应,实现非水系电解液的应用驱动型设计

Wang, Hansen; Yan, Xiaolin; Zhang, Rupeng; Sun, Juanjuan; Feng, Fuxiang; Li, Haoran; Liang, Jinding; Wang, Yuchun; Ye, Guangzhou; Luo, Xiaonan; Huang, Shengyuan; Wan, Pan; Hung, Samantha T; Ye, Fangjun; Chen, Fangyun; Wu, Erxiao; Zhou, Jinfei; Ulissi, Ulderico; Ge, Xiaoming; Liu, Chengyong; Xu, Bo; Liu, Na; Ouyang, Chuying

Genetic algorithm-accelerated computational discovery of liquid crystal polymers with enhanced optical properties

利用遗传算法加速计算发现具有增强光学性能的液晶聚合物

Zhou, Jianing; Huang, Yuge; Boromand, Arman; Noori, Keian; Purvis, Lafe; Oh, Chulwoo; Lu, Lu; Ulissi, Zachary W; Gharakhanyan, Vahe; Zhang, Xinyue

The Open DAC 2023 Dataset and Challenges for Sorbent Discovery in Direct Air Capture

Open DAC 2023 数据集及直接空气捕获中吸附剂发现的挑战

Sriram, Anuroop; Choi, Sihoon; Yu, Xiaohan; Brabson, Logan M; Das, Abhishek; Ulissi, Zachary; Uyttendaele, Matt; Medford, Andrew J; Sholl, David S

Reversal of Experimental Autoimmune Diabetes With an sCD39/Anti-CD3 Treatment

使用 sCD39/抗 CD3 治疗逆转实验性自身免疫性糖尿病

Carmen Fotino, R Damaris Molano, Moufida Ben Nasr, Oliver Umland, Christopher A Fraker, Ulisse Ulissi, Hari Baskar Balasubramanian, Maria Elena Lunati, Vera Usuelli, Andy Joe Seelam, Salma Ayman Khalefa, Christian La Sala, Jennifer Gimeno, Armando J Mendez, Camillo Ricordi, Allison L Bayer, Paolo Fi

Applying Large Graph Neural Networks to Predict Transition Metal Complex Energies Using the tmQM_wB97MV Data Set

应用大型图神经网络,利用 tmQM_wB97MV 数据集预测过渡金属配合物的能量

Garrison, Aaron G; Heras-Domingo, Javier; Kitchin, John R; Dos Passos Gomes, Gabriel; Ulissi, Zachary W; Blau, Samuel M

WhereWulff: A Semiautonomous Workflow for Systematic Catalyst Surface Reactivity under Reaction Conditions

WhereWulff:一种用于系统研究反应条件下催化剂表面反应性的半自主工作流程

Sanspeur, Rohan Yuri; Heras-Domingo, Javier; Kitchin, John R; Ulissi, Zachary

Alterations in Pregnenolone and Testosterone Levels in Male Shift Workers

男性轮班工人孕烯醇酮和睾酮水平的变化

Bracci, Massimo; Zingaretti, Laura; Martelli, Margherita; Lazzarini, Raffaella; Salvio, Gianmaria; Amati, Monica; Milinkovic, Marijana; Ulissi, Alfio; Medori, Anna Rita; Vitale, Ermanno; Ledda, Caterina; Santarelli, Lory

Effect of current density on the solid electrolyte interphase formation at the lithium∣Li(6)PS(5)Cl interface

电流密度对锂∣Li(6)PS(5)Cl界面处固体电解质界面形成的影响

Narayanan, Sudarshan; Ulissi, Ulderico; Gibson, Joshua S; Chart, Yvonne A; Weatherup, Robert S; Pasta, Mauro

Inhibition of Asaia in Adult Mosquitoes Causes Male-Specific Mortality and Diverse Transcriptome Changes

抑制成年蚊子体内Asaia基因会导致雄性蚊子特异性死亡和多种转录组变化

Mancini, Maria Vittoria; Damiani, Claudia; Short, Sarah M; Cappelli, Alessia; Ulissi, Ulisse; Capone, Aida; Serrao, Aurelio; Rossi, Paolo; Amici, Augusto; Kalogris, Cristina; Dimopoulos, George; Ricci, Irene; Favia, Guido