Unidad de diseño de fármacos y topología molecular
UDF-TM
KU Leuven
Lovaina, BélgicaPublicacions en col·laboració amb investigadors/es de KU Leuven (3)
2014
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Antiprotozoan lead discovery by aligning dry and wet screening: Prediction, synthesis, and biological assay of novel quinoxalinones
Bioorganic and Medicinal Chemistry, Vol. 22, Núm. 5, pp. 1568-1585
2011
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Discovery of novel anti-inflammatory drug-like compounds by aligning in silico and in vivo screening: The nitroindazolinone chemotype
European Journal of Medicinal Chemistry, Vol. 46, Núm. 12, pp. 5736-5753
2010
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Bond-based linear indices of the non-stochastic and stochastic edge-adjacency matrix. 1. Theory and modeling of ChemPhys properties of organic molecules
Molecular Diversity, Vol. 14, Núm. 4, pp. 731-753