Results 201 to 210 of about 119,327 (256)

Computational Discovery of Dual-Target LDHA/BRD4 Inhibitors Targeting the Lactate-Kla-B7-H3 Immunosuppressive Axis Through AI-Driven Virtual Screening. [PDF]

Pharmaceuticals (Basel)
Zhao R, Han M, Zhang B, Ma M, Zhou X, Sun J.   +5 more
europepmc   +1 more source

Electrohydraulic Folding Ring Actuators for Radially Contracting Applications

Advanced Science, EarlyView.
This work presents an Electrohydraulic Folding Ring Actuator that combines high‐performance electrohydraulic actuation with origami‐inspired folding geometry to achieve constricting radial actuation. This integration yields significant inner lumen constriction, alongside a gripping force capable of holding objects exceeding four times the actuator's ...
Gavril Yong En Tan, Quan Xiong, Jonathan William Ambrose, Zeynep Altundal, Raye Chen‐Hua Yeow   +4 more
wiley   +1 more source

From virtual screening to animal models: chlorhexidine and indinavir as promising anti-Zika drug candidates. [PDF]

Front Cell Infect Microbiol
Zhang HT, Peng ZY, Xiong JJ, Luo Y, Liu JH, Du YN, Hou YX, Deng SQ.   +7 more
europepmc   +1 more source

Diffusion‐Based Generative Model With Scaffold‐Hopping Strategy Yields Highly Potent Bioactive Molecules

Advanced Science, EarlyView.
SMarT‐Diff introduces a multi‐objective generative paradigm that integrates scaffold hopping with structure‐aware scoring to enable controlled exploration beyond the training distribution. The framework consistently balances drug‐likeness, synthesizes accessibility and bioactivity, yielding chemically diverse candidates with enhanced properties.
Yuwei Yang, Xiaoqing Gong, Shukai Gu, Jing Li, Bo Liu, Yanan Tian, Qianqian Zhang, Xiaojun Yao, Huanxiang Liu   +8 more
wiley   +1 more source

Virtual screening and molecular dynamics simulations for drug repurposing against autophagy to attenuate blast in cereal plants. [PDF]

Sci Rep
Rahman S, Rahman A, Huang YM, Hossen ML.
europepmc   +1 more source

From Label‐Free Multiphoton Imaging to Pathological Reports: A Vision‐Language Breast Cancer Margin Pathological Diagnosis System

Advanced Science, EarlyView.
MarginPath is a novel vision‐language system that automates breast cancer margin assessment using a single label‐free multiphoton microscopy image. By integrating tumor‐associated collagen signatures with virtual H&E imaging, it generates accurate margin heatmaps and comprehensive diagnostic reports.
Shu Wang, Jingze Su, Xiahui Han, Deyong Kang, Xiao Zhang, Fei Xu, Changzu Liu, Junlin Pan, Xingfu Wang, Qiaohui Zhan, Aimin Wang, Feng Huang, Heping Cheng, Wenxi Liu, Ruolan Lin, Jianxin Chen   +15 more
wiley   +1 more source

Identification of Putative Equilibrative Nucleoside Transporter Inhibitors Through Dual-Pharmacophore Virtual Screening and Validation in a Gemcitabine-Based Cell Assay. [PDF]

Molecules
Kremesh S, Ramadan A, Moutraji SA, Hasan S, Mahgoub RE, Coe IR, Sammani N, Abuamer L, Atatreh N, Ghattas MA.   +9 more
europepmc   +1 more source

Origami‐Mediated Low‐Voltage Electret Soft Robotic Actuators for Human‐Machine Haptic Interfaces

Advanced Science, EarlyView.
This work introduces an origami‐mediated soft electret actuator that combines compliant mechanical design and enhanced charge retention for low‐voltage vibrotactile feedback. The device delivers reliable tactile cues, demonstrates durable performance under continuous actuation, and enables intuitive interaction in applications such as tactile ...
Han Chen, Yongcheng He, Jingyi Liu, Yutong Yuan, Jianhua Li, Yizhuo Qian, Kai Wang, Jian Jiao, Raye Chen‐Hua Yeow   +8 more
wiley   +1 more source

RNAi-Mediated Silencing of vATPase Subunit E Impairs Larval Development in <i>Plutella xylostella</i>, and Virtual Screening Identifies a Potential Inhibitor. [PDF]

Insects
Yu X, Luo J, Xue J, Lu L, Deng P, Zhu L, Yang K, Wan X, Wu Y, Boboev A, Wu G, Yan X, Shen C.   +12 more
europepmc   +1 more source

Machine Learning-Based Virtual Screening for the Identification of Novel CDK-9 Inhibitors. [PDF]

Biomolecules
Piazza L, Poles C, Bononi G, Granchi C, Di Stefano M, Poli G, Giordano A, Medugno A, Napolitano GM, Tuccinardi T, Alfano L.   +10 more
europepmc   +1 more source