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Lluís Amat
Publication Activity (10 Years)
Years Active: 1997-2003
Publications (10 Years): 0
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Publications
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Ana Gallegos Saliner
,
Lluís Amat
,
Ramon Carbó-Dorca
,
T. Wayne Schultz
,
Mark T. D. Cronin
Molecular Quantum Similarity Analysis of Estrogenic Activity.
J. Chem. Inf. Comput. Sci.
43 (4) (2003)
Xavier Gironés
,
Lluís Amat
,
Ramon Carbó-Dorca
Modeling Large Macromolecular Structures Using Promolecular Densities.
J. Chem. Inf. Comput. Sci.
42 (4) (2002)
Lluís Amat
,
Emili Besalú
,
Ramon Carbó-Dorca
,
Robert Ponec
Identification of Active Molecular Sites Using Quantum-Self-Similarity Measures.
J. Chem. Inf. Comput. Sci.
41 (4) (2001)
Lluís Amat
,
Ramon Carbó-Dorca
Molecular Electronic Density Fitting Using Elementary Jacobi Rotations under Atomic Shell Approximation.
J. Chem. Inf. Comput. Sci.
40 (5) (2000)
Xavier Gironés
,
Lluís Amat
,
David Robert
,
Ramon Carbó-Dorca
Use of electron-electron repulsion energy as a molecular descriptor in QSAR and QSPR studies.
J. Comput. Aided Mol. Des.
14 (5) (2000)
David Robert
,
Lluís Amat
,
Ramon Carbó-Dorca
Three-Dimensional Quantitative Structure-Activity Relationships from Tuned Molecular Quantum Similarity Measures: Prediction of the Corticosteroid-Binding Globulin Binding Affinity for a Steroid Family.
J. Chem. Inf. Comput. Sci.
39 (2) (1999)
Lluís Amat
,
Ramon Carbó-Dorca
Fitted electronic density functions from H to Rn for use in quantum similarity measures: cis-diamminedichloroplatinum(II) complex as an application example.
J. Comput. Chem.
20 (9) (1999)
Robert Ponec
,
Lluís Amat
,
Ramon Carbó-Dorca
Molecular basis of quantitative structure-properties relationships (QSPR): A quantum similarity approach.
J. Comput. Aided Mol. Des.
13 (3) (1999)
Lluís Amat
,
David Robert
,
Emili Besalú
,
Ramon Carbó-Dorca
Molecular Quantum Similarity Measures Tuned 3D QSAR: An Antitumoral Family Validation Study.
J. Chem. Inf. Comput. Sci.
38 (4) (1998)
Lluís Amat
,
Ramon Carbó-Dorca
,
Robert Ponec
Molecular quantum similarity measures as an alternative to log P values in QSAR studies.
J. Comput. Chem.
19 (14) (1998)
Pere Constans
,
Lluís Amat
,
Ramon Carbó-Dorca
Toward a global maximization of the molecular similarity function: Superposition of two molecules.
J. Comput. Chem.
18 (6) (1997)