Results 241 to 250 of about 104,499 (295)

Protein Language Model‐Guided Engineering of a 2,3‐Butanediol Dehydrogenase for the Enantioselective Synthesis of Cyclic α‐Hydroxy Ketones

Advanced Science, EarlyView.
A (2R,3R)‐butanediol dehydrogenase from Bacillus subtilis (BsBDH) is engineered for the enantioselective synthesis of 2‐hydroxycyclohexanone. A PASS computational design strategy is proposed to enhance the thermostability of BsBDH. Moreover, ESM‐1v combined with ISM is utilized for enhancing and inverting its stereoselectivity.
Haote Ding, Ling Jiang, Yijia Song, Zhongji Pu, Lirong Yang, Haoran Yu   +5 more
wiley   +1 more source

Recoverable Fluorination Accelerates Ring-Opening Copolymerisation and Enables Post-Polymerisation-Modification of Polyesters. [PDF]

Angew Chem Int Ed Engl
Fornacon-Wood C, Steiner L, Xu C, Paulus B, Plajer AJ.   +4 more
europepmc   +1 more source

Novel Antifungal Scaffold Targeting Tubulin Overcomes Sclerotinia Sclerotiorum Resistance

Advanced Science, EarlyView.
Addressing pesticide resistance, novel chromone‐acylhydrazone hybrids targeting fungal tubulin are synthesized. Compound G24 potently inhibited S. sclerotiorum (EC50 = 0.21µg mL−1) and demonstrated enhanced field performance via microencapsulation, offering a sustainable strategy against resistance and for global food security.
Lihui Shao, Xianqun Hu, Ying Wu, Xiang Zhou, Bo Zhang, Song Yang   +5 more
wiley   +1 more source

Site-Selective Fluorination of Bathocuproine Derivatives for Enhanced Performance and Stability in Perovskite Solar Cells. [PDF]

ChemSusChem
Tran HN, Yeo D, Kwun DG, Chitumalla RK, Choi GC, Jang J, Jung IH, Seo JY.   +7 more
europepmc   +1 more source

High‐Performance Quasi‐Solid‐State Calcium‐Ion Batteries from Redox‐Active Covalent Organic Framework Electrolytes

Advanced Science, EarlyView.
Quasi‐solid‐state calcium‐ion batteries (QSSCIBs) employing redox‐active covalent organic frameworks (COFs) based electrolytes are developed. The COFs’ crystalline porous structures, featuring aligned carbonyl groups, enabled high Ca2⁺ conductivity, supported by molecular dynamics simulations of the ion transport mechanism.
Zhuoyu Yin, Jixin Wu, Ye Tian, Yufei Yuan, Muhua Gu, Lei Cheng, Yanming Wang, Yoonseob Kim   +7 more
wiley   +1 more source

Hydrolysis mechanisms for A-series (Novichok) nerve agents at different pH V and computational simulant screening. [PDF]

RSC Adv
Jia J, Duan W, Li Q, Xu X, Tian Z, Zhang Z.   +5 more
europepmc   +1 more source

Nuclear magnetic resonance studies of fluorine-19 containing hydrazides as probes for membrane glycoprotein.

, 1984
Nadarajah Karuppiah
openalex   +1 more source

DualPG‐DTA: A Large Language Model‐Powered Graph Neural Network Framework for Enhanced Drug‐Target Affinity Prediction and Discovery of Novel CDK9 Inhibitors Exhibiting in Vivo Anti‐Leukemia Activity

Advanced Science, EarlyView.
This study introduces DualPG‐DTA, a framework integrating two pre‐trained models to generate molecular and protein representations. It constructs dual graphs processed by specialized neural networks with dynamic attention for feature fusion, achieving superior benchmark performance.
Yihao Chen, Jindi Huang, Cong Liu, Shipeng Zhang, Xinze Li, Zhang Zhang, Tie‐Gen Chen, Ling Wang   +7 more
wiley   +1 more source

Impact of fluorine-containing nanoparticle PEGylation on inflammation imaging by ¹⁹F MRI. [PDF]

Sci Rep
Bouvain P, Schmitz J, Karg M, Temme S, Flögel U.   +4 more
europepmc   +1 more source

Trans‐A2B2‐Type Metalloporphyrin‐Based Donor–Acceptor Covalent Organic Frameworks for Efficient Photocatalytic CO2 Cycloaddition to Aziridines

Advanced Science, EarlyView.
Two novel trans‐A2B2‐type porphyrin‐based D‐A type covalent organic frameworks (COFs), including metal‐free m‐DBPA‐COF and metallized m‐NiDBPA‐COF, have been successfully synthesized and under visible light‐assisted and mild conditions (1 atm CO2 with no heating required), m‐NiDBPA‐COF exhibits remarkable photocatalytic performance, achieving a ...
Ji Xiong, Minghui Chen, Yunhao Xu, Yaqing Feng, Jian Song, Bao Zhang   +5 more
wiley   +1 more source