海量图书期刊资源,随时随地畅享阅读乐趣
Hydrophobic similarity between molecules: A MST-based hydrophobic similarity indexJ. Muñoz; X. Barril; B. Hernández; Modesto Orozco; F. Javier Luque · 2002
MDpocket: open-source cavity detection and characterization on molecular dynamics trajectoriesSchmidtke, P.; Bidon-Chanal, A.; Luque, F. J.; Barril, X. · Bioinformatics · 2011
A fluorescence polarization assay for inhibitors of Hsp90R. Howes; X. Barril; B.W. Dymock; K. Grant; C.J. Northfield; A.G.S. Robertson; A. Surgenor; J. Wayne; L. Wright; K. James; T. Matthews; K.-M. Cheung; E. McDonald; P. Workman; M.J. Drysdale · 2006
Transferability of fragmental contributions to the octanol/water partition coefficient: An NDDO-based MST studyC. Curutchet; A. Salichs; X. Barril; Modesto Orozco; F. Javier Luque · 2003
Salt bridge interactions: Stability of the ionic and neutral complexes in the gas phase, in solution, and in proteinsX. Barril; C. Alemán; M. Orozco; F.J. Luque · 1998
How accurate can molecular dynamics/linear response and Poisson–Boltzmann/solvent accessible surface calculations be for predicting relative binding affinities? Acetylcholinesterase huprine inhibitors as a test caseX. Barril; J. L. Gelpí; J. M. López; M. Orozco; F. J. Luque · 2001
SATE Pronucleotide Approaches: An OverviewPeyrottes, S. · Mini Reviews in Medicinal Chemistry · 2004
Antitumour QuinonesAsche, C. · Mini-Reviews in Medicinal Chemistry · 2005
Knowledge-Driven Lead DiscoveryPirard, Bernard · Mini-Reviews in Medicinal Chemistry · 2005
Natural Products as Angiogenesis ModulatorsEl Sayed, K. · Mini-Reviews in Medicinal Chemistry · 2005
Antiangiogenesis by Chemotherapeutic AgentsRibatti, Domenico; Vacca, Angelo; Merchionne, Francesca; Presta, Marco · Mini-Reviews in Medicinal Chemistry · 2005
Recent Advances in Antifungal AgentsLorand, Tamas; Kocsis, Bela · Mini-Reviews in Medicinal Chemistry · 2007
Leptin, Estrogens and CancerMaeso Fortuny, Maria del Carmen; Brito Diaz, Buenaventura; Cabrera de Leon, Antonio · Mini-Reviews in Medicinal Chemistry · 2006
Thyrotropin-Releasing Hormone AnalogsColson, A.; Gershengorn, M. · Mini-Reviews in Medicinal Chemistry · 2006