Results 161 to 170 of about 26,891,998 (226)

Discovery of Novel Anti-Acetylcholinesterase Peptides Using a Machine Learning and Molecular Docking Approach. [PDF]

Drug Des Devel Ther
Xiao W, Chen LZ, Chang J, Xiao YW.
europepmc   +1 more source

Enhancing ERα-targeted compound efficacy in breast cancer threapy with ExplainableAI and GeneticAlgorithm. [PDF]

PLoS One
Pun Z, Xue Q, Zhang Y.
europepmc   +1 more source

UMAP-based clustering split for rigorous evaluation of AI models for virtual screening on cancer cell lines. [PDF]

J Cheminform
Guo Q, Hernandez-Hernandez S, Ballester PJ.   +2 more
europepmc   +1 more source

Beyond performance: How design choices shape chemical language models

Fender I, Gut JA, Lemmin T.
europepmc   +1 more source

Integration of MRI radiomics and germline genetics to predict the IDH mutation status of gliomas. [PDF]

NPJ Precis Oncol
Nakase T, Henderson GA, Barba T, Bareja R, Guerra G, Zhao Q, Francis SS, Gevaert O, Kachuri L.   +8 more
europepmc   +1 more source

Building molecular model series from heterogeneous CryoEM structures using Gaussian mixture models and deep neural networks. [PDF]

Commun Biol
Chen M.
europepmc   +1 more source

Improving drug-drug interaction prediction via in-context learning and judging with large language models. [PDF]

Front Pharmacol
Qi H, Li X, Zhang C, Zhao T.
europepmc   +1 more source

Machine learning-based stratification of prediabetes and type 2 diabetes progression. [PDF]

Diabetol Metab Syndr
Matboli M, Khaled A, Ahmed MF, Ahmed MY, Khaled R, Elmakromy GM, Ghani AMA, El-Shafei MM, Abdelhalim MRM, Gwad AMAE.   +9 more
europepmc   +1 more source