Results 171 to 180 of about 877,520 (249)

Prediction of physicochemical properties of organic compounds using degree-based topological indices and machine learning models. [PDF]

Sci Rep
Noureen S, Ashraf N, Azam S, Aslam A, Tola KA.   +4 more
europepmc   +1 more source

To Be or Not to Be Eutectic: Anomalous Glass Forming Ability Governed by Melt Structural Complexity

Advanced Science, EarlyView.
Challenging the eutectic rule, congruently melting Ti–Cu alloys show greater glass‐forming ability than their eutectic counterparts. This arises from the congruent melt's structural complexity: higher cluster diversity and stronger inter‐cluster correlations from entropy–enthalpy competition.
Wei Chen, Xuerui Wei, Chengzhe Wang, Zhichao Lu, Fan Zhang, Yan Huang, Yibo Zhang, Liang Wang, Saichao Cao, Chunyin Zhou, Ke Yang, Zhendong Fu, Jinkui Zhao, Dongbai Sun, Fanqiang Meng, Zhou Zhou, Xun‐li Wang, Weihua Wang, Dong Ma   +18 more
wiley   +1 more source

Exploring topological indices and power curve fitting models for predicting heat of formation in magnesium aluminate network. [PDF]

Sci Rep
Nazir S, Siddiqui MK, Hayat H, Gegbe B.
europepmc   +1 more source

Therapeutic Peptide‐Programmed Liquid‐Crystalline Topology Switching for pH‐Gated Postoperative Cancer Immunotherapy

Advanced Science, EarlyView.
A VDAP‐programmed liquid‐crystalline depot enables pH‐responsive postoperative immunotherapy for triple‐negative breast cancer. VDAP stabilizes a leakage‐resistant HII mesophase through peptide–lipid electrostatic assembly, whereas tumor acidosis unlocks the matrix and promotes graded topology remodeling toward a bicontinuous Im3̄m cubic phase for ...
Yan Yan, Bin Chen, Yanqing Wang, Yuxi Hou, Zhenlin Ma, Zini Yang, Xia Yin, Yiling Chen, Litao Huang, Menghan Cai, Xinlin Liu, Yi Zhun Zhu, Li Ye   +12 more
wiley   +1 more source

Comparative structural analysis of certain covalent organic frameworks through entropy and degree-based topological indices. [PDF]

Sci Rep
Sajeev F, S R, K J, B GK.
europepmc   +1 more source

Metasurface‐Based Multidimensional Light‐Field Manipulation: From Technologies to Applications

Advanced Science, EarlyView.
Multidimensional metasurfaces enable versatile manipulation of multiple optical degrees of freedom, including phase, amplitude, polarization, wavelength, and orbital angular momentum. This review summarizes their fundamental mechanisms, emerging strategies for multidimensional light‐field control, and key applications in optical computing, imaging ...
Heliang Yin, Shuo Sun, Jiahao Zhang, Jianuo Hu, Yubin Qiao, Liang Chen, Jin Li   +6 more
wiley   +1 more source

ChemGraphX: an open-source web tool for computing topological indices and entropy measures. [PDF]

J Cheminform
Jacob K, Clement J, Arockiaraj M, Jindal A.   +3 more
europepmc   +1 more source

An AI‐Driven Framework for Directed Self‐Assembly Toward Design‐Technology Co‐Optimization

Advanced Science, EarlyView.
An artificial intelligence (AI)‐driven closed‐loop framework integrates experiment, three‐dimensional physics‐based simulation, and template design for directed self‐assembly (DSA). Guided by experimental data, AI‐assisted calibration accelerates model optimization, supports morphology prediction, and identifies template windows.
Caiwei Shang, Yanting Xu, Yue Zhang, Yan Zhang, Jianfeng Li, Ming Li, Longlin Lei, Wenda Bao, Weixuan Zeng, Shisheng Xiong   +9 more
wiley   +1 more source

Leveraging topological indices and machine learning for advanced prediction of antidepressant drug properties. [PDF]

Sci Rep
Zhang G, Noureen S, Azam S, Abdalla MEM, Dafaalla ME, Aslam A, Tola KA.   +6 more
europepmc   +1 more source

Gapless Complete Genome and Multi‐Omics Illuminate Immune Adaptation and Host‐Virus Interactions in a Coronavirus Reservoir

Advanced Science, EarlyView.
We present a complete T2T genome assembly for a key bat reservoir. Integrating population genomics, comparative genomics, transcriptomics, single‐cell omics, and functional assays, we resolve previously inaccessible genomic regions and identify evolutionary signatures associated with immune adaptation.
Yuting Wang, Sheng Zhang, Linxia Ouyang, Xin Du, Xin Huang, Zhilin Wang, Huixian Xie, Jiale Tang, Liyi Lou, Wenqing Ling, Weihao Wang, Jiang Zhou, Zhen Liu, Yibo Hu, Fuwen Wei, Guangping Huang   +15 more
wiley   +1 more source