Results 191 to 200 of about 37,266 (256)

A Unified Hierarchical Multiscale Fusion Framework for Drug–Target Affinity Prediction: From Benchmark Performance to Nanomolar Inhibitor Discovery

Advanced Science, EarlyView.
A multimodal fusion framework integrating sequence, atomic, and fragment representations captures drug–target interactions across multiple scales. The model delivers strong predictive performance and enables efficient virtual screening. Applied to hematopoietic progenitor kinase 1 (HPK1), it identifies structurally diverse inhibitors with nanomolar ...
Shuo Liu, Xiang Zhang, Haixia Feng, Yuquan Li, Xiaoqing Gong, Yong Liang, Xiaojun Yao, Huanxiang Liu   +7 more
wiley   +1 more source

Spin and Optical Fingerprints of Pressure-Driven Double Topological Phase Transition in Monoclinic BaIn₂As₂. [PDF]

ACS Omega
Guo WT, Zhang JM.
europepmc   +1 more source

ZrCo3B2 and HfCo3B2 Electrodes Go on Stage for Oxygen Evolution Reaction

Advanced Science, EarlyView.
The intermetallic compounds ZrCo3B2 and HfCo3B2 with distinctive chemical bonding features are excellent OER precursors, restructuring into OER‐active electrocatalysts delivering significantly high OER activities compared to the elemental Co, which is obvious from their lower onset potentials and increased obtained current densities.
Fatma Aras, Ulrich Burkhardt, Simone G. Altendorf, Yuri Grin, Iryna Antonyshyn   +4 more
wiley   +1 more source

Tunable arbitrarily located quasi-corner states in multiphase weak topological insulator. [PDF]

Nat Commun
Lou M, Li X, Qiu J, Tan D.
europepmc   +1 more source

A Reconfigurable Memristive Spiking Neuron Enabling Advanced Neuromorphic Computing

Advanced Science, EarlyView.
Pek Jun Tiw and co‐workers develop a reconfigurable memristive neuron that can exhibit four spiking behaviors with freely tunable spike train parameters. The neuron supports multiplexed spike encoding of multiple pieces of information. It also supports advanced neural network strategies, such as neural heterogeneity and dynamic mode switching ...
Pek Jun Tiw, Yuqi Li, Zhongyuan Li, Qihang Ding, Yuzhe Wang, Jiarong Wang, Yuchao Yang   +6 more
wiley   +1 more source

High-topological charge extreme-ultraviolet spatiotemporal vortices via high harmonic generation

Martin-Hernandez R, Gui G, Plaja L, Kapteyn H, Murnane M, Liao C, Porras M, Hernández-García C.   +7 more
europepmc   +1 more source

High-order photonic degeneracy enables topological reconfiguration in bound states in the continuum. [PDF]

Nat Commun
Fu Z, Chen Y, Shi F, Jin R, Guo J, Zhang Y, Yu F, Chen J, Huang L, Zhou C, Chen X, Lu W, Alù A, Li G, Qiu CW.   +14 more
europepmc   +1 more source

Structural Basis of Shiga Toxin Neutralization by Human Antibodies Targeting Canonical Receptor‐Binding and Non‐Canonical Assembly Sites

Advanced Science, EarlyView.
Cryo‐electron microscopy structures reveal two distinct neutralization mechanisms of fully human monoclonal antibodies targeting the Shiga toxin 1a B subunit. RDS059 occludes the Gb3 receptor‐binding site, whereas RDS045 engages a lateral quaternary epitope to disrupt holotoxin assembly.
Jianting Ke, Xin Li, Xiaoli Wang, Zhaoxia Huang, Shaojie Xue, Yuyang Liu, Jing Pan, Guowei Hu, Yayu Wang, Cheng Wang, Shoudeng Chen   +10 more
wiley   +1 more source

Frequency conversion of highly charged femtosecond spatiotemporal optical vortices in cascaded nonlinear crystals. [PDF]

Nat Commun
Liang Q, Wang D, Zhang Q, Hu J, Zhang E, Wang M, Wu J, Swartzlander GA, Liu Y.   +8 more
europepmc   +1 more source

Emergent Magnetism, Heavy Electrons, and Pressure‐Induced Reentrant Superconductivity in the Iron Substituted 4d Transition‐Metal Sulfides

Advanced Science, EarlyView.
This work illustrates that magnetic Fe substitution enables systematic modulation of physical properties of the putative unconventional superconductor Rh17S15. Iron doping uncovers delicate competition between weak ferromagnetism, spin‐glass states, heavy‐fermion signatures, and superconductivity.
Yalei Huang, Lu Xin, Na Zuo, Bin Li, Wei Zhou, Dhanarajagopal Alltrin, Boning Yu, Haiyang Yang, Bin Qian, Wen‐Chin Lin, Raman Sankar, Michael Smidman, Xiangzhuo Xing, Chunqiang Xu, Xiaobing Liu, Jianhui Dai, Dong Qian, Shiyan Li, Xiaofeng Xu   +18 more
wiley   +1 more source