Results 161 to 170 of about 17,914 (270)

Computational Phenotypic Drug Discovery for Anticancer Chemotherapy: PTML Modeling of Multi-Cell Inhibitors of Colorectal Cancer Cell Lines. [PDF]

Int J Mol Sci
Speck-Planche A, Cordeiro MNDS.
europepmc   +1 more source

Correlated Dual‐Gradient Electrodes Enabling Spatially Synchronized Sulfur Redox in High‐Mass‐Loading Li–S Batteries Under High Current Densities

Advanced Materials, EarlyView.
Coupling a dual‐gradient carbonized framework with Fe2O3/Fe‐N‐C catalytic sites enables spatially synchronized sulfur redox across the entire electrode thickness in high‐mass‐loading Li–S batteries. This synergistic structural–catalytic design effectively mitigates concentration, ohmic, and electrochemical polarization, thereby achieving high‐capacity ...
Yuxuan Zhang, Yeongjun Oh, Jinwook Baek, Minyoung Kim, Zachary Didat, Han Wook Song, Sunghwan Lee   +6 more
wiley   +1 more source

Novel eigenvector centrality indices for octane isomers to explore their physicochemical properties. [PDF]

Sci Rep
Rani ASJ, Balamurugan BJ.
europepmc   +1 more source

High Charge Carrier Mobility in Non‐Conjugated 3D Covalent Organic Frameworks

Advanced Materials, EarlyView.
A non‐conjugated 3D COF constructed via boronate ester linkages from tetraphenylene and pyrene‐based monomers is reported, which exhibits a high charge carrier mobility of 14 ± 1 cm2 V−1 s−1. ABSTRACT π‐Conjugation, π–π stacking, and long‐range order play a central role in determining charge transport efficiency in organic materials.
Joaquín Almarza, Karol Strutyński, Shuai Fu, Yifan Chen, Natalia M. Padial, Isabel del Barrio Gómez, Carlos Martí‐Gastaldo, Andrei N. Khlobystov, Mischa Bonn, Hai I. Wang, Manuel Melle‐Franco, Aurelio Mateo‐Alonso   +11 more
wiley   +1 more source

A QSPR study of coronary artery disease drugs using eccentricity-based indices. [PDF]

Sci Rep
Iqbal N, Akhter S, Alraih AM, Iqbal Z, Aslam A, Tola KA.   +5 more
europepmc   +1 more source

2D MOF with Intrinsic Porosity for Colorimetric Volatile Organic Compounds (VOCs) Detection

Advanced Materials, EarlyView.
An uncommon 2D MOF with intrinsic in‐plane porosity that can be mechanically exfoliated undergoes a distinct and reversible colour change upon exposure to various volatile organic compounds. ABSTRACT In this work, we report an uncommon 2D metal–organic framework (MOF) with intrinsic in‐plane porosity that undergoes a distinct and reversible colour ...
Sergio R. Gamarra, Alberto Fernández‐Alarcón, Joaquín Calbo, Enrique Ortí, Guillermo Mínguez Espallargas   +4 more
wiley   +1 more source

A Learning Framework for Atomic-Level Polymer Structure Generation. [PDF]

Chem Mater
Jain A, Srivastava A, Ramprasad R.
europepmc   +1 more source

Self‐Assembled Monolayers in p–i–n Perovskite Solar Cells: Molecular Design, Interfacial Engineering, and Machine Learning–Accelerated Material Discovery

Advanced Materials, EarlyView.
This review highlights the role of self‐assembled monolayers (SAMs) in perovskite solar cells, covering molecular engineering, multifunctional interface regulation, machine learning (ML) accelerated discovery, advanced device architectures, and pathways toward scalable fabrication and commercialization for high‐efficiency and stable single‐junction and
Asmat Ullah, Ying Luo, Stefaan De Wolf
wiley   +1 more source

On statistical analysis of topological indices and heat of formation for titanium diboride network. [PDF]

Sci Rep
Ismail R, Saher R, Hanif MF, Hanif MF, Siddiqui MK, Fufa SA.   +5 more
europepmc   +1 more source

Matrix Stiffness Governs Fibroblasts’ Regulation of Gingival Immune Homeostasis

Advanced Materials, EarlyView.
This study identifies a “mechano‐epigenetic” checkpoint in which matrix stiffness governs the immune responses of gingival fibroblasts. Using biomimetic hydrogels and human gingival explants, the studies revealed that restoring extracellular matrix stiffness actively suppresses inflammation via non‐canonical NF‐κB signaling and DNA methylation ...
Hardik Makkar, Nghi Tran, Yu‐Chang Chen, Kang I. Ko, Rebecca G. Wells, Kyle H. Vining   +5 more
wiley   +1 more source