OpenLB
Open Library of Bioscience
Advanced Search

Journal

Publication Year

1 year 3 years 5 years 10 years
2021 - 2032
202120222023
202420252026
202720282029
203020312032
2021 - 2032
202120222023
202420252026
202720282029
203020312032

Publication Type

Associated Data

Found 57 results

Filters: PTML

Ligand-Based Approach for Multi-Target Drug Discovery: PTML Modeling of Triple-Target Inhibitors.
Valeria V Kleandrova, M Nat��lia D S Cordeiro, Alejandro Speck-Planche
Curr Top Med Chem. Aug 21, 2024.: Print-Electronic
Source:PubMed
PMID: 39171594 doi:10.2174/0115680266325897240815112505
Machine Learning and Perturbation Theory Machine Learning (PTML) in Medicinal Chemistry, Biotechnology, and Nanotechnology.
Diana M Herrera-Ibatá
Curr Top Med Chem. 2021.21(7):649-660 Print
Source:PubMed
PMID: 33475073 doi:10.2174/1568026621666210121153413
PTML Model of ChEMBL Compounds Assays for Vitamin Derivatives.
Ricardo Santana, Robin Zuluaga, Piedad Gañán, Sonia Arrasate, Enrique Onieva Caracuel, Humbert González-Díaz
ACS Comb Sci. 03 09, 2020.22(3):129-141 Print-Electronic
Source:PubMed
PMID: 32011854 doi:10.1021/acscombsci.9b00166
Multi-target Drug Discovery via PTML Modeling: Applications to the Design of Virtual Dual Inhibitors of CDK4 and HER2.
Valeria V Kleandrova, Marcus T Scotti, Luciana Scotti, Alejandro Speck-Planche
Curr Top Med Chem. 2021.21(7):661-675 Print
Source:PubMed
PMID: 33463472 doi:10.2174/1568026621666210119112845
PTML Multi-Label Algorithms: Models, Software, and Applications.
Bernabe Ortega-Tenezaca, Viviana Quevedo-Tumailli, Harbil Bediaga, Jon Collados, Sonia Arrasate, Gotzon Madariaga, Cristian R Munteanu, M Natália D S Cordeiro, Humbert González-Díaz
Curr Top Med Chem. 2020.20(25):2326-2337 Print
Source:PubMed
PMID: 32938352 doi:10.2174/1568026620666200916122616
Multioutput Perturbation-Theory Machine Learning (PTML) Model of ChEMBL Data for Antiretroviral Compounds.
Emilia Vásquez-Domínguez, Vinicio Danilo Armijos-Jaramillo, Eduardo Tejera, Humbert González-Díaz
Mol Pharm. 10 07, 2019.16(10):4200-4212 Print-Electronic
Source:PubMed
PMID: 31426639 doi:10.1021/acs.molpharmaceut.9b00538
Stability of Pt near surface alloys under electrochemical conditions: a model study.
Xiaoming Zhang, Shansheng Yu, Weitao Zheng, Ping Liu
Phys Chem Chem Phys. Aug 21, 2014.16(31):16615-22 Print
Source:PubMed
PMID: 24994557 doi:10.1039/c4cp01942c
Perturbation-Theory and Machine Learning (PTML) Model for High-Throughput Screening of Parham Reactions: Experimental and Theoretical Studies.
Lorena Simón-Vidal, Oihane García-Calvo, Uxue Oteo, Sonia Arrasate, Esther Lete, Nuria Sotomayor, Humberto González-Díaz
J Chem Inf Model. 07 23, 2018.58(7):1384-1396 Print-Electronic
Source:PubMed
PMID: 29898360 doi:10.1021/acs.jcim.8b00286
PTML Model for Selection of Nanoparticles, Anticancer Drugs, and Vitamins in the Design of Drug-Vitamin Nanoparticle Release Systems for Cancer Cotherapy.
Ricardo Santana, Robin Zuluaga, Piedad Gañán, Sonia Arrasate, Enrique Onieva, Matthew M Montemore, Humbert González-Díaz
Mol Pharm. 07 06, 2020.17(7):2612-2627 Print-Electronic
Source:PubMed
PMID: 32459098 doi:10.1021/acs.molpharmaceut.0c00308
PTML Modeling for Alzheimer's Disease: Design and Prediction of Virtual Multi-Target Inhibitors of GSK3B, HDAC1, and HDAC6.
Valeria V Kleandrova, Alejandro Speck-Planche
Curr Top Med Chem. 2020.20(19):1661-1676 Print
Source:PubMed
PMID: 32515311 doi:10.2174/1568026620666200607190951
0