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1.
Development of Novel Methods for QSAR Modeling by Machine Learning Repeatedly: A Case Study on Drug Distribution to Each Tissue.
J Chem Inf Model
; 64(9): 3662-3669, 2024 May 13.
Artículo
en Inglés
| MEDLINE | ID: mdl-38639496
2.
Prediction of Compound Plasma Concentration-Time Profiles in Mice Using Random Forest.
Mol Pharm
; 20(6): 3060-3072, 2023 06 05.
Artículo
en Inglés
| MEDLINE | ID: mdl-37096989
3.
Predicting Total Drug Clearance and Volumes of Distribution Using the Machine Learning-Mediated Multimodal Method through the Imputation of Various Nonclinical Data.
J Chem Inf Model
; 62(17): 4057-4065, 2022 09 12.
Artículo
en Inglés
| MEDLINE | ID: mdl-35993595
4.
Development of a Novel In Silico Classification Model to Assess Reactive Metabolite Formation in the Cysteine Trapping Assay and Investigation of Important Substructures.
Biomolecules
; 14(5)2024 Apr 30.
Artículo
en Inglés
| MEDLINE | ID: mdl-38785942
5.
Development of a 2D-QSAR Model for Tissue-to-Plasma Partition Coefficient Value with High Accuracy Using Machine Learning Method, Minimum Required Experimental Values, and Physicochemical Descriptors.
Eur J Drug Metab Pharmacokinet
; 48(4): 341-352, 2023 Jul.
Artículo
en Inglés
| MEDLINE | ID: mdl-37266860
6.
On the difficulty of validating molecular generative models realistically: a case study on public and proprietary data.
J Cheminform
; 15(1): 112, 2023 Nov 21.
Artículo
en Inglés
| MEDLINE | ID: mdl-37990215
7.
Prediction of Total Drug Clearance in Humans Using Animal Data: Proposal of a Multimodal Learning Method Based on Deep Learning.
J Pharm Sci
; 110(4): 1834-1841, 2021 04.
Artículo
en Inglés
| MEDLINE | ID: mdl-33497658
8.
Calcium ions are involved in the delay of plant cell cycle progression by abiotic stresses.
FEBS Lett
; 580(2): 597-602, 2006 Jan 23.
Artículo
en Inglés
| MEDLINE | ID: mdl-16405971
9.
Three-dimensional quantitative structure-activity relationship analysis for human pregnane X receptor for the prediction of CYP3A4 induction in human hepatocytes: structure-based comparative molecular field analysis.
J Pharm Sci
; 104(1): 223-32, 2015 Jan.
Artículo
en Inglés
| MEDLINE | ID: mdl-25381754
10.
In silico study on the inhibitory interaction of drugs with wild-type CYP2D6.1 and the natural variant CYP2D6.17.
Drug Metab Pharmacokinet
; 29(1): 52-60, 2014.
Artículo
en Inglés
| MEDLINE | ID: mdl-23857029
11.
Three-dimensional quantitative structure-activity relationship analysis of inhibitors of human and rat cytochrome P4503A enzymes.
Drug Metab Pharmacokinet
; 28(4): 345-55, 2013.
Artículo
en Inglés
| MEDLINE | ID: mdl-23358262
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