Search

Theoretical and Computational Chemistry

Working Paper

An Exploration Strategy Improves the Diversity of de novo Ligands Using Deep Reinforcement Learning – A Case for the Adenosine A2A Receptor

Xuhan Liu, Kai Ye, Herman Van Vlijmen, Adriaan P. IJzerman, Gerard JP Van westen

Version 3 posted 16 April 2019

1,344

Downloads

Materials Science

Working Paper

Intermolecular pi-pi-packing-induced thermally activated delayed fluorescence: a novel pathway toward luminescence efficiency of nearly 100%

Kai Wang, Xiao-Chun Fan, Dandan Zhang, Youichi Tsuchiya, Le Mei, Yi-Zhong Shi, Masaki Tanaka, Zesen Lin, Yi-Ting Lee, Yue Xie, Yuanyuan Pan, Xiang Zhang, Wei Liu, Gao-Le Dai, Jia-Xiong Chen, Bing Wu, Jun Zhong, Jian-Yu Yuan, Cai-Jun Zheng, Jia Yu, Alex K. Y. Jen, Xian-Kai Chen, Chun-Sing Lee, Chihaya Adachi, Xiaohong Zhang

Version 2 posted 02 February 2023

2,470

Downloads

2

Citations

Materials Science

Working Paper

Tunable Boc Modification of Lignin and Its Impact on Microbial Degradation Rate

Liuqun Gu, Meifeng Wang, Hui Li, Kai Ni Teh, Yiqun Li, Ye Liu

Version 4 posted 06 May 2021

1,204

Downloads

1

Citations

Energy

Working Paper

Lithium Ferrocyanide Catholyte for High-Capacity Aqueous Redox Flow Batteries

Xiaotong Li, Yuan Yao, Xin Jia, Chenxi Liu, Jiahuang Jian, Bao Guo, Kai Cui, Songtao Lu, Yang Li, Wei Qin, Qing Wang, Xiaohong Wu

Version 1 posted 29 September 2022

735

Downloads

Biological and Medicinal Chemistry

Working Paper

A two-stage MS feature dereplication strategy for natural products discovery

Ran Zhang, Beilun Wang, Chang Wang, Kaihong Huang, Zhaoguo Li, Jinling Yang, Jingyu Kuang, Lihan Ren, Mengjun Wu, Kai Zhang, Han Xie, Yu Liu, Min Wu, Yihan Wu, Fei Xu

Version 1 posted 06 June 2024

177

Downloads

Polymer Science

Working Paper

Carboxylic Acid-Catalyzed Controlled Ring-Opening Polymerization of Sarcosine N-Carboxyanhydride: Fast Kinetics, Ultra-High Molecular Weight, and Mechanistic Insights

Shuo Wang, Ming-Yuan Lu, Si-Kang Wan, Chun-Yan Lyu, Zi-You Tian, Kai Liu, Hua Lu

Version 1 posted 05 October 2023

567

Downloads

1

Citations

Theoretical and Computational Chemistry

Working Paper

Knowledge Discovery from Porous Organic Cages Literature Using a Large Language Model

Yaoyi Su, Siyuan Yang, Yuanhan Liu, Aiting Kai, Linjiang Chen, Ming Liu

Version 1 posted 23 October 2024

140

Downloads

Organic Chemistry

Working Paper

Departure from Randomness: Evolution of Self-Replicators that can Self-Sort through Steric Zipper Formation

Marcel Eleveld, Juntian Wu, Kai Liu, Jim Ottelé, Omer Markovitch, Armin Kiani, Sijbren Otto

Version 1 posted 19 July 2023

274

Downloads

Organic Chemistry

Working Paper

Selection for Photocatalytic Function through Darwinian Evolution of Synthetic Self-Replicators

Kai Liu, Omer Markovitch, Chris van Ewijk, Yari Katar Knelissen, Armin Kiani, Marcel Eleveld, Wouter H. Roos, Sijbren Otto

Version 2 posted 13 August 2024

539

Downloads

Nanoscience

Working Paper

Effect of Filler Surface Chemistry on the Multifunctional Properties of GNP Epoxy Nanocomposites

Vicente Orts Mercadillo, Happiness Ijije, Pietro Steiner, Kai Chio Chan, Mufeng Liu, Ian A. Kinloch, Mark Bissett

Version 1 posted 29 May 2024

97

Downloads

Refine Search

39 results in Kai Liu in Authors: Kai Liu

An Exploration Strategy Improves the Diversity of de novo Ligands Using Deep Reinforcement Learning – A Case for the Adenosine A2A Receptor

Intermolecular pi-pi-packing-induced thermally activated delayed fluorescence: a novel pathway toward luminescence efficiency of nearly 100%

Tunable Boc Modification of Lignin and Its Impact on Microbial Degradation Rate

Lithium Ferrocyanide Catholyte for High-Capacity Aqueous Redox Flow Batteries

A two-stage MS feature dereplication strategy for natural products discovery

Carboxylic Acid-Catalyzed Controlled Ring-Opening Polymerization of Sarcosine N-Carboxyanhydride: Fast Kinetics, Ultra-High Molecular Weight, and Mechanistic Insights

Knowledge Discovery from Porous Organic Cages Literature Using a Large Language Model

Departure from Randomness: Evolution of Self-Replicators that can Self-Sort through Steric Zipper Formation

Selection for Photocatalytic Function through Darwinian Evolution of Synthetic Self-Replicators

Effect of Filler Surface Chemistry on the Multifunctional Properties of GNP Epoxy Nanocomposites

39 results in Authors: Kai Liu