Detalhe da pesquisa
1.
Feature Selection for Polymer Informatics: Evaluating Scalability and Robustness of the FS4RVDD Algorithm Using Synthetic Polydisperse Data Sets.
J Chem Inf Model
; 60(2): 592-603, 2020 02 24.
Artigo
Inglês
| MEDLINE | ID: mdl-31790226
2.
QSPR models for predicting log P(liver) values for volatile organic compounds combining statistical methods and domain knowledge.
Molecules
; 17(12): 14937-53, 2012 Dec 17.
Artigo
Inglês
| MEDLINE | ID: mdl-23247367
3.
QSAR Classification Models for Predicting the Activity of Inhibitors of Beta-Secretase (BACE1) Associated with Alzheimer's Disease.
Sci Rep
; 9(1): 9102, 2019 06 24.
Artigo
Inglês
| MEDLINE | ID: mdl-31235739
4.
Visual analytics in cheminformatics: user-supervised descriptor selection for QSAR methods.
J Cheminform
; 7: 39, 2015.
Artigo
Inglês
| MEDLINE | ID: mdl-26300983
5.
Target-Driven Subspace Mapping Methods and Their Applicability Domain Estimation.
Mol Inform
; 30(9): 779-89, 2011 Sep.
Artigo
Inglês
| MEDLINE | ID: mdl-27467410