Results 181 to 190 of about 59,414 (293)

Multiple Topology Replica Exchange of Expanded Ensembles for Multidimensional Alchemical Calculations. [PDF]

J Chem Theory Comput
Friedman AJ, Hsu WT, Shirts MR.
europepmc   +1 more source

Unveiling Phonon Contributions to Thermal Conductivity and the Applicability of the Wiedemann—Franz Law in Ruthenium and Tungsten Thin Films

Advanced Functional Materials, EarlyView.
Thermal transport in Ru and W thin films is studied using steady‐state thermoreflectance, ultrafast pump–probe spectroscopy, infrared‐visible spectroscopy, and computations. Significant Lorenz number deviations reveal strong phonon contributions, reaching 45% in Ru and 62% in W.
Md. Rafiqul Islam, Pravin Karna, Niraj Bhatt, Sandip Thakur, Helge Heinrich, Daniel M. Hirt, Saman Zare, Christopher Jezewski, Rinus T.P. Lee, Kandabara Tapily, John T. Gaskins, Colin D. Landon, Sean W. King, Ashutosh Giri, Patrick E. Hopkins   +14 more
wiley   +1 more source

refineDLC: An advanced post-processing pipeline for DeepLabCut outputs. [PDF]

Biol Methods Protoc
Klecel W, Rahael H, Brooks SA.
europepmc   +1 more source

Ionic Control of Microstructure and Lubrication in Charged, Physically Cross‐Linked Hydrogels

Advanced Functional Materials, EarlyView.
Here, charged, physically cross‐linked poly(methacrylamide‐co‐methacrylic acid) hydrogels stabilized by a short‐range attractive, long‐range repulsive potential is investigated. This work uncovers how salt addition alters not only swelling, but also the microstructure and dynamics, near‐surface stiffness and charge, and ultimately, its lubricity. Salts
Alexander Deptula, Rosa M. Espinosa‐Marzal   +1 more
wiley   +1 more source

A novel framework for secure cryptocurrency transactions using quantum crypto guard. [PDF]

PeerJ Comput Sci
Alsayaydeh JAJ, Yusof MF, Yahaya NA, Kovtun V, Herawan SG.   +4 more
europepmc   +1 more source

Electroactive Metal–Organic Frameworks for Electrocatalysis

Advanced Functional Materials, EarlyView.
Electrocatalysis is crucial in sustainable energy conversion as it enables efficient chemical transformations. The review discusses how metal–organic frameworks can revolutionize this field by offering tailorable structures and active site tunability, enabling efficient and selective electrocatalytic processes.
Irena Senkovska, Yutong Luo, Ruyan Zhao, Jianjun Zhang, Mingchao Wang, Xinliang Feng, Eike Brunner, Stefan Kaskel   +7 more
wiley   +1 more source

Fragment-based discovery enables direct targeting of the melanoma oncogene MITF. [PDF]

Nat Commun
Castelletti D, Hinrichs J, Malojčić G, Ji F, Desplat A, Reimer B, Henry C, Porter KA, Mermet-Meillon F, Wartmann M, Wirth E, Delmas C, Fernández C, Mayer PHO, Schmiedeberg N, Plattner S, Brun J, Kläusler S, Kurmann J, Yan K, Fuller J, Schaeffer F, Maddalo D, Altorfer M, Piperidou N, Pautrieux N, Baysang F, Kaufmann M, Cobos-Correa A, Wilcken R, Renatus M, Vulpetti A, Jahnke W.   +32 more
europepmc   +1 more source

On‐Surface Indigo‐Based Bimolecular Coordination Networks with Programmable Regular or Vitreous Structure

Advanced Functional Materials, EarlyView.
A previously unreported coordination motif stabilising single Fe atoms by indigo chelation and pyridyl coordination on Au(111) has been revealed. By using planar tritopic pyridyl linkers (TPyB), extended 2D porous networks of indigo3(TPyB)2Fe6 form. These networks can be crystalline or vitreous and offer an environment where individual coordination ...
Hongxiang Xu, Ritam Chakraborty, Biao Yang, Dennis Meier, Joachim Reichert, Svetlana Klyatskaya, Mario Ruben, Shobhana Narasimhan, Johannes V. Barth, Anthoula C. Papageorgiou   +9 more
wiley   +1 more source

An exploratory pre-post test evaluation of an online family cooking intervention: Up for Cooking. [PDF]

J Nutr Sci
Harms LSE, Gubbels JS, van Assema P, Gerards SMPL, Bessems KMHH.   +4 more
europepmc   +1 more source

Photoswitching Conduction in Framework Materials

Advanced Functional Materials, EarlyView.
This mini‐review summarizes recent advances in state‐of‐the‐art proton and electron conduction in framework materials that can be remotely and reversibly switched on and off by light. It discusses the various photoswitching conduction mechanisms and the strategies employed to enhance photoswitched conductivity.
Helmy Pacheco Hernandez, Stefan Hecht, Wolfgang Wenzel, Lars Heinke, Mariana Kozlowska   +4 more
wiley   +1 more source