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Accounts of Chemical Research(1)
Journal of Chemical Information and Computer Sciences(1)
Journal of Computer-Aided Molecular Design(1)
SAR and QSAR in environmental research(1)
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scopus(4)
Antimalarial activity of synthetic 1,2,4-trioxanes and cyclic peroxy ketals, a quantum similarity study
ArticleAbstract: In this work, the antimalarial activity of two series of 20 and 7 synthetic 1,2,4-trioxanes and a sePalabras claves:1,2,4-trioxanes, Artemisinin, MALARIA, MQSM, Peroxy ketals, Plasmodium falciparum, QSAR, Quantum SimilarityAutores:Gallegos A., Gironés X., Ramón Carbö-D̈orcaFuentes:scopusMolecular quantum similarity and the fundamentals of QSAR
ArticleAbstract: A general overview on quantum similarity and applications to QSAR is presented. The concepts regardiPalabras claves:Autores:Amat L., Besalu E., Gironés X., Ramón Carbö-D̈orcaFuentes:scopusMolecular quantum similarity-based QSARs for binding affinities of several steroid sets
ArticleAbstract: The application of Molecular Quantum Similarity Measures (MQSM) to correlate biological activities fPalabras claves:Autores:Gironés X., Ramón Carbö-D̈orcaFuentes:scopusUsing molecular quantum similarity measures as descriptors in quantitative structure-toxicity relationships.
ArticleAbstract: In this paper molecular quantum similarity measures (MQSM) are used to describe molecular toxicity aPalabras claves:Autores:Amat L., Gironés X., Ramón Carbö-D̈orcaFuentes:scopus