Emili Besalú

Publication Activity (10 Years)

Years Active: 1994-2021
Publications (10 Years): 1

Top Topics

Energy Function

Statistical Models

Neural Network Model

Top Venues

Publications

Emili Besalú
The Dependent Chip Model (DCM): a simple and more realistic alternative to the Independent Chip Model (ICM). CoRR (2021)
Ramon Carbó-Dorca, Emili Besalú, Luz Dary Mercado
Communications on quantum similarity, part 3: A geometric-quantum similarity molecular superposition algorithm. J. Comput. Chem. 32 (4) (2011)
Ramon Carbó-Dorca, Emili Besalú
Communications on quantum similarity (2): A geometric discussion on holographic electron density theorem and confined quantum similarity measures. J. Comput. Chem. 31 (13) (2010)
Emili Besalú, Jesús Vicente de Julián-Ortiz, Lionello Pogliani
Trends and Plot Methods in MLR Studies. J. Chem. Inf. Model. 47 (3) (2007)
Josep Maria Anglada, Emili Besalú, Josep Maria Bofill, Ramon Crehuet
On the quadratic reaction path evaluated in a reduced potential energy surface model and the problem to locate transition states. J. Comput. Chem. 22 (4) (2001)
Josep Maria Anglada, Emili Besalú, Josep Maria Bofill, Ramon Crehuet
On the quadratic reaction path evaluated in a reduced potential energy surface model and the problem to locate transition states. J. Comput. Chem. 22 (7) (2001)
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)
Josep Maria Anglada, Emili Besalú, Josep Maria Bofill, Ramon Crehuet
Prediction of approximate transition states by Bell-Evans-Polanyi principle: I. J. Comput. Chem. 20 (11) (1999)
Josep Maria Anglada, Emili Besalú, Josep Maria Bofill, Ramon Crehuet
Prediction of approximate transition states by Bell-Evans-Polanyi principle: II. Gas phase unimolecular decomposition of methyldioxirane. J. Comput. Chem. 20 (11) (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)
Emili Besalú, Josep Maria Bofill
Calculation of clustered eigenvalues of large matrices using variance minimization method. J. Comput. Chem. 19 (15) (1998)
Ramon Carbó, Emili Besalú
Definition, Mathematical Examples and Quantum Chemical Applications of Nested Summation Symbols and Logical Kronecker Deltas. Comput. Chem. 18 (2) (1994)