Results 251 to 260 of about 2,795,372 (389)

Distance-dependent: characterizing virtual screening datasets

Chemistry Central Journal, 2009
Baumann K, Rohrer SG, Anthes C
doaj   +1 more source

Data-Driven Virtual Screening of Conformational Ensembles of Transition-Metal Complexes. [PDF]

J Chem Theory Comput
Finta S, Kalikadien AV, Pidko EA.
europepmc   +1 more source

Modulating G-Protein Coupled Receptor/G-Protein Signal Transduction by Small Molecules Suggested by Virtual Screening [PDF]

, 2008
Christina Taylor, Yaniv Barda, Oleg G. Kisselev, Garland R. Marshall   +3 more
openalex   +1 more source

STAT6 Activation Exacerbates Ferroptosis in Airway Epithelium by Inhibiting PRKN‐Mediated Mitophagy in Pulmonary Fibrosis

Advanced Science, EarlyView.
This study uncovers STAT6‐driven pulmonary fibrosis (PF) via suppression of PRKN‐mediated airway epithelial mitophagy, triggering mitochondrial dysfunction and ferroptosis. Rifabutin is identified as a potent STAT6 inhibitor that effectively reverses fibrotic progression. These findings reveal the STAT6‐PRKN axis as a pathogenic regulator and provide a
Youjing Yang, Guangbin Huang, Tao Zhang, Yi Ling, Junyu Jiang, Dingyuan Du, Yu Ma, Shasha Tao   +7 more
wiley   +1 more source

New Inhibitors of β-1,4-Galactosyltransferase I Discovered by Virtual Screening. [PDF]

ChemMedChem
Kranjc J, Tomašič T, Pajk S, Brinc M, Pišlar A, Anderluh M.   +5 more
europepmc   +1 more source

Exploring benchmark dataset bias in ligand based virtual screening [PDF]

, 2008
Knut Baumann, SG Rohrer
openalex   +1 more source

Toward the Clinical Translation of Implantable Brain–Computer Interfaces for Motor Impairment: Research Trends and Outcome Measures

Advanced Science, EarlyView.
Implantable brain–computer interfaces (iBCIs) are rapidly approaching clinical translation. This review maps key trends in the development of iBCIs and highlights the lack of standardised clinical outcome measures. It discusses a proposed framework for the selection of outcome measures in clinical trials and introduces a new international registry of ...
Esmee Dohle, Eleanor Swanson, Luka Jovanovic, Suraya Yusuf, Lucy Thompson, Hugo Layard Horsfall, William Muirhead, Luke Bashford, Jamie Brannigan   +8 more
wiley   +1 more source

Discovery of novel HBV core protein inhibitors by high throughput virtual screening. [PDF]

Sci Rep
Sanchitra J, Debnath A, Singh AK, Jha AK, Singh RK.   +4 more
europepmc   +1 more source

Virtual Screening as a Technique for PPAR Modulator Discovery [PDF]

, 2009
Stephanie N. Lewis, Josep Bassaganya‐Riera, David R. Bevan   +2 more
openalex   +1 more source

MoS2 Channel‐Enhanced High‐Density Charge Trap Flash Memory and Machine Learning‐Assisted Sensing Methodologies for Memory‐Centric Computing Systems

Advanced Science, EarlyView.
Driven by AI computing demands, this study investigates MoS2 channels for 3D NAND Flash to achieve high‐density, low‐power, and reliable nonvolatile memory. MoS2 enables a large memory window and lower operating voltages with low‐k tunneling layer, demonstrating endurance of 10⁴ cycles and retention of 10⁵ s. Comprehensive analyses and machine learning‐
Ki Han Kim, Ju Han Park, Khang June Lee, Ji‐Won Seo, Yeong Kwon Kim, Junhwan Choi, Min‐Jae Seo, Byung Chul Jang   +7 more
wiley   +1 more source