Search Result "molecular graph machines"
Molecular Electrostatic Potential as a Graph
Journal: Current Computer-Aided Drug Design
Volume: 9 Issue: 2 Year: 2013 Page: 272-280
Author(s): Edgar E. Daza,Julio Maza,Raul Torres
Bio-AIMS Collection of Chemoinformatics Web Tools based on Molecular Graph Information and Artificial Intelligence Models
Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 18 Issue: 8 Year: 2015 Page: 735-750
Author(s): Cristian R. Munteanu,Humberto Gonzalez-Diaz,Rafael Garcia,Mabel Loza,Alejandro Pazos
Future Applications of Photo-Driven Molecular Machines
Journal: Current Physical Chemistry
Volume: 1 Issue: 3 Year: 2011 Page: 261-274
Author(s): Da-Hui Qu, He Tian
Learning the Edit Costs of Graph Edit Distance Applied to Ligand-Based Virtual Screening
Journal: Current Topics in Medicinal Chemistry
Volume: 20 Issue: 18 Year: 2020 Page: 1582-1592
Author(s): Carlos Garcia-Hernandez,Alberto Fernández,Francesc Serratosa
Kernel-Based Feature Selection Techniques for Transport Proteins Based on Star Graph Topological Indices
Journal: Current Topics in Medicinal Chemistry
Volume: 13 Issue: 1 Year: 2013 Page: 1681-1691
Author(s): Carlos Fernandez-Lozano, Marcos Gestal, Nieves Pedreira-Souto, Lucian Postelnicu, Julian Dorado, Cristian Robert Munteanu
Graph Neural Networks with Multi-features for Predicting Cocrystalsusing APIs and Coformers Interactions
Journal: Current Medicinal Chemistry
Volume: 31 Issue: 36 Year: 2024 Page: 5953-5968
Author(s):
Graph Convolutional Capsule Regression (GCCR): A Model for AcceleratedFiltering of Novel Potential Candidates for SARS-CoV-2 based on BindingAffinity
Journal: Current Computer-Aided Drug Design
Volume: 20 Issue: 1 Year: 2024 Page: 33-41
Author(s):
Star Graphs of Protein Sequences and Proteome Mass Spectra in Cancer Prediction
Journal: Current Proteomics
Volume: 6 Issue: 4 Year: 2009 Page: 275-288
Author(s): Jose M. Vazquez, Vanessa Aguiar, Jose A. Seoane, Ana Freire, Jose A. Serantes, Julian Dorado, Alejandro Pazos, Cristian R. Munteanu
Graphical Representations of Protein Sequences for Alignment-Free Comparative and Predictive Studies. Recognition of Protease Inhibition Pattern from H-Depleted Molecular Graph Representation of Protease Sequences
Journal: Current Bioinformatics
Volume: 5 Issue: 4 Year: 2010 Page: 241-252
Author(s): Michael Fernandez, Julio Caballero, Leyden Fernandez, Akinori Sarai
Molecular Dynamics Simulation of MNT
Ebook: Micro and Nanomachining Technology-Size, Model and Complex Mechanism
Volume: 1 Year: 2014
Author(s): Xuesong Han
Doi: 10.2174/9781608057696114010005