Relevance of theoretical molecular descriptors in quantitative structure–activity relationship analysis of α1-adrenergic receptor antagonists von Menziani, M.C., Montorsi, M., De Benedetti, P.G., Karelson, M.

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Theoretical descriptors in quantitative structure–affinity and selectivity relationship study of potent N4-substituted arylpiperazine 5-HT1 A receptor antagonists von Menziani, M.C, De Benedetti, P.G, Karelson, M

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Theoretical investigation of IL-6 multiprotein receptor assembly von Menziani, M.C., Fanelli, F., De Benedetti, P.G.

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Structure-Function Relationships of the α1b-Adrenergic Receptor von Scheer, A., Fanelli, F., Diviani, D., de Benedetti, P.G., Cotecchia, S.

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α1-Adrenoceptor subtype selectivity: Molecular modelling and theoretical quantitative structure—affinity relationships von De Benedetti, P.G., Fanelli, F., Menziani, M.C., Cocchi, M., Testa, R., Leonardi, A.

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Computational simulations of stem-cell factor/c-Kit receptor interaction von Menziani, M.C., Fanelli, F., De Benedetti, P.G.

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Computational simulations of agonist/antagonist interactions with the alpha1-adrenoceptor von De Benedetti, P.G., Fanelli, F., Menziani, M.C., Cocchi, M., Leonardi, A.

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Multinuclear NMR and vibrational spectroscopy studies of the substituent effects in benzensulphonamide inhibitors of the enzyme carbonic anhydrase von de Benedetti, P.G., Iarossi, D., Menziani, M.C., Frassineti, C., Benedetti, A.

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Electrostatics in quantitative structure-activity relationship analysis von De Benedetti, P.G.

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Sequence-directed recognition peptides (SDRP) inhibitors of human big endothelin (BigET) proteolysis, molecular design, modeling and dynamics of the BigET-SDRP complexes von Menziani, M.C., Cocchi, M., De Benedetti, P.G.

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Conformational analysis and theoretical quantitative size and shape-affinity relationships of N4-protonated N1-arylpiperazine 5-HT1A serotoninergic ligands von Cocchi, M., Fanelli, F., Menziani, M.C., De Benedetti, P.G.

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Conformational analysis and theoretical quantitative size and shape-affinity relationships of N 4-protonated N 1-arylpiperazine 5-HT 1A serotoninergic ligands von Cocchi, M., Fanelli, F., Menziani, M.C., De Benedetti, P.G.

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Comparative molecular dynamics study of the seven-helix bundle arrangement of G-protein coupled receptors von Fanelli, F., Menziani, M.C., Cocchi, M., De Benedetti, P.G.

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Quantitative structure-affinity/selectivity relationship analysis on three-dimensional models of the complexes between the ET A and ET B receptors and C-terminal endothelin hexapep... von Menziani, M.C., Cocchi, M., Fanelli, F., De Benedetti, P.G.

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The ad hoc supermolecule approach to receptor ligand design von De Benedetti, P.G., Fanelli, F., Menziani, M.C., Cocchi, M.

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Theoretical quantitative size and shape activity and selectivity analyses of 5-HT 1A serotonin and α 1-adrenergic receptor ligands von De Benedetti, P.G., Cocchi, M., Menziani, M.C., Fanelli, F.

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Quantitative structure-affinity/selectivity relationship analysis on three-dimensional models of the complexes between the ETA and ETB receptors and C-terminal endothelin hexapepti... von Menziani, M.C., Cocchi, M., Fanelli, F., De Benedetti, P.G.

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The heuristic-direct approach to theoretical quantitative structure-activity relationship analysis of α1-adrenoceptor ligands von Fanelli, F., Menziani, M.C., Cocchi, M., Leonardi, A., De Benedetti, P.G.

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A molecular dynamics simulation of sequence-directed recognition peptides interacting with bigendothelin von Menziani, M.C., Cocchi, M., De Benedetti, P.G.

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Modeling of sulfonamide derivatives into carbonic anhydrase active site von De Benedetti, P.G., Menziani, M.C., Cocchi, M., Richards, W.G.

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