Search results for "chemoinformatic"

Hits ?▲	Authors	Title	Venue	Year	Link	Author keywords
85	Rafael Peláez, Roberto Therón, Carlos Armando García, José Luis López-Pérez, Manuel Medarde	Design of New Chemoinformatic Tools for the Analysis of Virtual Screening Studies: Application to Tubulin Inhibitors.	IWPACBB	2008	DBLP DOI BibTeX RDF	clustering, drug design, virtual screening, tubulin
63	Gilles Bisson, Ludovic Patey	Les " arbres empilés ": une nouvelle approche pour la visualisation des grands dendrogrammes.	IHM	2009	DBLP DOI BibTeX RDF	large classification, stacked trees, hierarchical clustering, chemoinformatic
59	Rafael Peláez, José Luis López-Pérez, Manuel Medarde	Application of Chemoinformatic Tools for the Analysis of Virtual Screening Studies of Tubulin Inhibitors.	Innovations in Hybrid Intelligent Systems	2008	DBLP DOI BibTeX RDF	drug design, virtual screening, tubulin
32	José L. Medina-Franco, Norberto Sánchez-Cruz, Edgar López-López, Bárbara I. Díaz-Eufracio	Progress on open chemoinformatic tools for expanding and exploring the chemical space.	J. Comput. Aided Mol. Des.	2022	DBLP DOI BibTeX RDF
32	Ningfeng Liu, Junyong Lai, Chuanyu Lyu, Bo Qiang, Heyu Wang, Hongwei Jin, Liangren Zhang, Zhenming Liu	Chemical Space, Scaffolds, and Halogenated Compounds of CMNPD: A Comprehensive Chemoinformatic Analysis.	J. Chem. Inf. Model.	2021	DBLP DOI BibTeX RDF
32	Fernanda I. Saldívar-González, Marilia Valli, Adriano D. Andricopulo, Vanderlan da Silva Bolzani, José L. Medina-Franco	Chemical Space and Diversity of the NuBBE Database: A Chemoinformatic Characterization.	J. Chem. Inf. Model.	2019	DBLP DOI BibTeX RDF
32	Björn-Oliver Gohlke	Chemoinformatische Datenintegration zur Analyse und Vorhersage von Interaktionen von kleinen organischen Molekülen mit deren Biomolekülen (Chemoinformatic data integration to analyse and predict drug-target interactions)		2017	RDF
32	Tiago B. Oliveira, Leonardo Gobbo-Neto, Thomas J. Schmidt 0001, Fernando B. Da Costa	Study of Chromatographic Retention of Natural Terpenoids by Chemoinformatic Tools.	J. Chem. Inf. Model.	2015	DBLP DOI BibTeX RDF
32	Suleiman A. Khan, Ali Faisal, John Mpindi, Juuso A. Parkkinen, Tuomo Kalliokoski, Antti Poso, Olli-P. Kallioniemi, Krister Wennerberg, Samuel Kaski	Comprehensive data-driven analysis of the impact of chemoinformatic structure on the genome-wide biological response profiles of cancer cells to 1159 drugs.	BMC Bioinform.	2012	DBLP DOI BibTeX RDF
32	Ying-Ying Jiang, De-Xin Kong, Tao Qin, Xiao Li 0010, Gustavo Caetano-Anollés, Hong-yu Zhang	The Impact of Oxygen on Metabolic Evolution: A Chemoinformatic Investigation.	PLoS Comput. Biol.	2012	DBLP DOI BibTeX RDF
32	María P. Magariños, John P. Overington, Santiago J. Carmona, Dhanasekaran Shanmugam, Maria A. Doyle, Stuart A. Ralph, Gregory J. Crowther, Christiane Hertz-Fowler, Solomon Nwaka, Matthew Berriman, David S. Roos, Wesley C. Van Voorhis, Fernán Agüero	Designing and implementing chemoinformatic approaches in TDR Targets Database: linking genes to chemical compounds in tropical disease causing pathogens.	BMC Bioinform.	2010	DBLP DOI BibTeX RDF
32	Narender Singh, Rajarshi Guha, Marc A. Giulianotti, Clemencia Pinilla, Richard A. Houghten, José L. Medina-Franco	Chemoinformatic Analysis of Combinatorial Libraries, Drugs, Natural Products, and Molecular Libraries Small Molecule Repository.	J. Chem. Inf. Model.	2009	DBLP DOI BibTeX RDF
32	Anders Wallqvist, Ruili Huang, David G. Covell	Chemoinformatic Analysis of NCI Preclinical Tumor Data: Evaluating Compound Efficacy from Mouse Xenograft Data, NCI-60 Screening Data, and Compound Descriptors.	J. Chem. Inf. Model.	2007	DBLP DOI BibTeX RDF
32	Kerby Shedden, Julie Brumer, Young Tae Chang, Gustavo R. Rosania	Chemoinformatic Analysis of a Supertargeted Combinatorial Library of Styryl Molecules.	J. Chem. Inf. Comput. Sci.	2003	DBLP DOI BibTeX RDF
26	Maneesh K. Yadav, Brian P. Kelley, Steven M. Silverman	The Potential of a Chemical Graph Transformation System.	ICGT	2004	DBLP DOI BibTeX RDF