Search Result "Nano-QSPR"
Nano-QSPR Modelling of Carbon-Based Nanomaterials Properties
Journal: Current Topics in Medicinal Chemistry
Volume: 15 Issue: 18 Year: 2015 Page: 1868-1886
Author(s): Maryam Salahinejad
Use of Quasi-SMILES and Monte Carlo Optimization to Develop Quantitative Feature Property/Activity Relationships (QFPR/QFAR) for Nanomaterials
Journal: Current Topics in Medicinal Chemistry
Volume: 15 Issue: 18 Year: 2015 Page: 1837-1844
Author(s): Andrey A. Toropov,Robert Rallo,Alla P. Toropova
The Monte Carlo Method Based on Eclectic Data as an Efficient Tool for Predictions of Endpoints for Nanomaterials - Two Examples of Application
Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 18 Issue: 4 Year: 2015 Page: 376-386
Author(s): Andrey A. Toropov, Alla P. Toropova, Aleksandar M. Veselinovic, Jovana B. Veselinovic, Karel Nesmerak, Ivan Raska, Pablo R. Duchowicz, Eduardo A. Castro, Valentin O. Kudyshkin, Danuta Leszczynska, Jerzy Leszczynski
Matrix Trace Operators: From Spectral Moments of Molecular Graphs and Complex Networks to Perturbations in Synthetic Reactions, Micelle Nanoparticles, and Drug ADME Processes
Journal: Current Drug Metabolism
Volume: 15 Issue: 4 Year: 2014 Page: 470-488
Author(s): Humberto Gonzalez-Diaz,Sonia Arrasate,Asier Gomez-San Juan,Nuria Sotomayor,Esther Lete,Alejandro Speck-Planche,Juan M. Ruso,Feng Luan,Maria Natalia Dias Soeiro Cordeiro
Topological Indices and Total Energy of Zig-Zag Polyhex Nanotubes
Journal: Current Nanoscience
Volume: 9 Issue: 4 Year: 2013 Page: 502-513
Author(s): Mehdi Eliasi
Machine Learning and Perturbation Theory Machine Learning (PTML) in Medicinal Chemistry, Biotechnology, and Nanotechnology
Journal: Current Topics in Medicinal Chemistry
Volume: 21 Issue: 7 Year: 2021 Page: 649-660
Author(s): Diana M. Herrera-Ibatá
SMILES in QSPR/QSAR Modeling: Results and Perspectives
Journal: Current Drug Discovery Technologies
Volume: 4 Issue: 2 Year: 2007 Page: 77-116
Author(s): Andrey A. Toropov, Emilio Benfenati
Ligand and Structure-based Modeling of Passive Diffusion through the Blood-Brain Barrier
Journal: Current Medicinal Chemistry
Volume: 25 Issue: 9 Year: 2018 Page: 1073-1089
Author(s): Santiago Vilar,Eduardo Sobarzo-Sanchez,Lourdes Santana,Eugenio Uriarte
Metal Oxide Nanoparticles: Size-Dependence of Quantum-Mechanical Properties
Journal: Nanoscience & Nanotechnology-Asia
Volume: 1 Issue: 1 Year: 2011 Page: 53-58
Author(s): Agnieszka Gajewicz, Tomasz Puzyn, Bakhtiyor Rasulev, Danuta Leszczynska, Jerzy Leszczynski
Graphical Abstracts:
Journal: Current Topics in Medicinal Chemistry
Volume: 15 Issue: 18 Year: 2015 Page: i-vi
Author(s):