Results 121 to 130 of about 4,221,215 (159)

Research on the optimization model of anti-breast cancer candidate drugs based on machine learning. [PDF]

Front Genet
Dong Z, Chen H, Yang Y, Hao H.
europepmc   +1 more source

Domain adaptable language modeling of chemical compounds identifies potent pathoblockers for Pseudomonas aeruginosa. [PDF]

Commun Chem
Kallergis G, Asgari E, Empting M, Hirsch AKH, Klawonn F, McHardy AC.   +5 more
europepmc   +1 more source

QSPR analysis of amino acids for the family of Gourava indices. [PDF]

PLoS One
Sarwar K, Kanwal S, Razzaque A.
europepmc   +1 more source

Development of SAFT-Based Coarse-Grained Models of Carbon Dioxide and Nitrogen. [PDF]

J Phys Chem B
Chremos A, Krekelberg WP, Hatch HW, Siderius DW, Mahynski NA, Shen VK.   +5 more
europepmc   +1 more source

A Perspective on Foundation Models in Chemistry. [PDF]

JACS Au
Choi J, Nam G, Choi J, Jung Y.
europepmc   +1 more source

Comprehensive analysis of prognosis markers with molecular features derived from pan-cancer whole-genome sequences. [PDF]

Hum Genomics
Kato M, Nishino J, Nagai M, Rokutan H, Narushima D, Ono H, Hasegawa T, Imoto S, Matsui S, Tsunoda T, Shibata T.   +10 more
europepmc   +1 more source

Unified Deep Learning of Molecular and Protein Language Representations with T5ProtChem. [PDF]

J Chem Inf Model
Kelly T, Xia S, Lu J, Zhang Y.
europepmc   +1 more source

Enhancing fluorescent probe design through multilayer interaction convolutional networks: advancing biosensing and bioimaging precision. [PDF]

Chem Sci
Ma G, Ding Q, Zhang Y, Zeng X, Zhu K, Chen H, Zhang W, Wang Q, Huang S, Gong P, Xu Z, Hong X.   +11 more
europepmc   +1 more source

In Silico High-Performance Liquid Chromatography Method Development via Machine Learning. [PDF]

Anal Chem
Marchetto A, Tirapelle M, Mazzei L, Sorensen E, Besenhard MO.   +4 more
europepmc   +1 more source

Probabilistic classification of gene-by-treatment interactions on molecular count phenotypes. [PDF]

PLoS Genet
Harigaya Y, Matoba N, Le BD, Valone JM, Stein JL, Love MI, Valdar W.   +6 more
europepmc   +1 more source