Results 261 to 270 of about 217,958 (282)

Uncovering Key Characteristics of Antibacterial Peptides through Machine Learning

Macromolecular Rapid Communications, EarlyView.
Machine‐learning (ML) techniques using random forest classification models revealed key characteristics that predict effective antimicrobial peptides (AMPs) targeting Gram‐negative bacteria, Gram‐positive bacteria, and mycobacteria. The ideal cLogP (<$ < $−6) and net‐charge (≤+4) threshold was the same for all three targets with variations in the ...
Jooyoung Roh, Cyrille Boyer, Priyank V. Kumar   +2 more
wiley   +1 more source

An integrated geomechanical-drill string trajectory optimization method for initial wellbore design. [PDF]

Sci Rep
Guo S, Liu Z, Su X, Liu Y, Li Q, Wang L, Qu F.   +6 more
europepmc   +1 more source

Structure‐Aware Machine Learning for Polymers: A Hierarchical Graph Network for Predicting Properties From Statistical Ensembles

Macromolecular Rapid Communications, EarlyView.
This work presents a structure‐aware graph convolutional network that models polymers as statistical ensembles to predict macroscopic properties. By combining topologically realistic graphs generated via kinetic Monte Carlo simulations with explicit molar mass distributions, the framework achieves high accuracy in classifying architectures and ...
Julian Kimmig, Yannik Köster, Timo Koswig, Punith Raviswamy, Subhash V. S. Ganti, Stefan Zechel, Christopher Kuenneth, Ulrich S. Schubert   +7 more
wiley   +1 more source

Surgical adjuncts in minimally invasive repair of pectus excavatum and carinatum deformities: techniques for internal visualization, sternal elevation, and depression. [PDF]

J Thorac Dis
Park HJ, Rim G, Yoon SK, DiFiore JW.
europepmc   +1 more source

Evaluation of Nanoparticle-Based Plasma Enrichment on Individuals with Primary and Metastatic Pancreatic Cancer. [PDF]

Cancers (Basel)
Ang CS, Williamson NA, Dumesny C, Leeming MG, Datta K, Varshney S, Nikfarjam M, He H.   +7 more
europepmc   +1 more source

Unraveling the mechanisms of nicotine-induced osteoporosis via network toxicology, bioinformatics, and molecular docking. [PDF]

Tob Induc Dis
Xu S, Wang G, Liu J, Zhang X, Dong X, Liang J, Bai T.   +6 more
europepmc   +1 more source

Prediction of primary human targets and toxicity mechanisms of imidacloprid using integrative <i>In Silico</i> approaches. [PDF]

Toxicol Rep
Boonyong C, Powthong P.
europepmc   +1 more source

Characterising commensal and pathogenic staphylococcal interactions with neonatal and adult blood. [PDF]

Sci Rep
Joubert IA, Mullally C, Wang P, Chopra A, Strunk T, Currie A.   +5 more
europepmc   +1 more source

Impact of zinc and chromium deficiency on gene expression in type 2 diabetes mellitus. [PDF]

Sci Rep
Nayyar H, Bhatti A, John P.
europepmc   +1 more source