Results 151 to 160 of about 17,914 (270)

Structural Exploration and Expected values of Topological Indices of Square-Hexagonal <i>T</i> _2,3 Kink Chains for Advanced Engineering Applications. [PDF]

ACS Omega
Kanwal S, Khalil M, Razzaque A.
europepmc   +1 more source

Azaporphyrinoid‐Based Photo‐ and Electroactive Architectures for Advanced Functional Materials

Advanced Materials, EarlyView.
A long‐standing collaboration between the Torres and Guldi groups has yielded diverse azaporphyrinoid‐based donor‐acceptor nanohybrids with promising applications in solar energy conversion. This conspectus highlights key molecular platforms and structure‐function relationships that govern light and charge management, supporting the rational design of ...
Jorge Labella, Kobra Azizi, Dirk M. Guldi, Tomás Torres   +3 more
wiley   +1 more source

Grammar-driven SMILES standardization with <i>TokenSMILES</i>. [PDF]

Chem Sci
Gonzalez-Ortiz LA, Noriega L, Ortiz-Chi F, Vidales-Ayala G, Soberanis-Cáceres E, Meneses-Viveros A, Aspuru-Guzik A, Merino G.   +7 more
europepmc   +1 more source

3D Anodic Alumina Nanoarchitectures: A Decade of Progress from Foundational Science to Functional Metamaterials

Advanced Materials, EarlyView.
Ordered three‐dimensional anodic aluminum oxide (3D‐AAO) nanoarchitectures with longitudinal and transverse pores enable architecture‐driven metamaterials. The review maps fabrication advances, including hybrid pulse anodization, and shows how 3D‐AAO templates tailor properties across magnetism, energy, catalysis, and sensing.
Marisol Martín‐González
wiley   +1 more source

Topological and entropic characterization of nitrogenated holey graphene. [PDF]

Sci Rep
Prabhu S, Arulperumjothi M, Jose Parvin Praveena N, Manuel P.   +3 more
europepmc   +1 more source

Notes on trees with minimal atom-bond connectivity index

, 2012
If G = (V, E) is a molecular graph, and d(u) is the degree of its vertex u, then the atom-bond connectivity index of G is \(ABC = \sum_{uv\in E} \sqrt{[d(u) + d(v) − 2]/[d(u) d(v)]}\). This molecular structure descriptor, introduced by Estrada et al. in the late 1990s, found recently interesting applications in the study of the thermodynamic stability ...
Gutman, Ivan, Furtula, Boris, Ivanović, Miloš   +2 more
openaire   +1 more source

Improving Ionic Conformality Across Polymer Electrolyte|Electrode Interfaces

Advanced Materials, EarlyView.
Polymer electrolytes typically form physically intimate electrode interfaces but often fail to maintain continuous ionic pathways, critically limiting battery performance. Through strategic compositional design, this study introduces a molecular ionic composite electrolyte that effectively reduces interfacial ionic depletion, ensuring consistent ion ...
Jungki Min, Nicholas F. Pietra, Callum Connor, Zhaohui Liang, Erin C. Jackson, Lei Tao, Dawei Xia, Xu Feng, Dominik Wierzbicki, Seong‐Min Bak, Robert B. Moore, Louis A. Madsen, Feng Lin   +12 more
wiley   +1 more source

Novel temperature-based spectral topological indices for QSPR modeling of polyacenes in predicting physicochemical properties. [PDF]

Sci Rep
Hayat S, Alanazi SJF, Belay MB, Wang S.
europepmc   +1 more source

Atom-bond connectivity index versus Graovac-Ghorbani analog

, 2016
Published
openaire   +1 more source

Decoupling Dynamics and Crosslink Stability in Supramolecular Hydrogels Using Associative Exchange

Advanced Materials, EarlyView.
How does reorganization impact the stability of supramolecular hydrogels? In contrast to dissociative crosslink exchange, implementing associative exchange in macroscale DNA hydrogels enables decoupling of reorganization dynamics from thermal and mechanical stability.
Pierre Le Bourdonnec, Charafeddine Ferkous, Léo Comunale, Luca Cipelletti, Rémi Merindol   +4 more
wiley   +1 more source