Jean-Louis Rivail

发表

Étude par voie diélectrique de l'oxyde de nickel pur ou contenant des cations étrangers

Jean-Louis Rivail, 1966 .

Théorie du champ de réaction dynamique en relaxation diélectrique discussion sur le cas du chloroforme liquide

Jean-Louis Rivail, Jean-Louis Greffe, José Goulon, 1973 .

Specific force field parameters determination for the hybrid ab initio QM/MM LSCF method

Jean-Louis Rivail, Xavier Assfeld, Nicolas Ferré, 2002, J. Comput. Chem..

Iterative stochastic subspace self-consistent field method

Jean-Louis Rivail, Xavier Assfeld, Pierre-François Loos, 2013, Journal of Molecular Modeling.

A coupled density functional-molecular mechanics Monte Carlo simulation method: The water molecule in liquid water

Marilia T. C. Martins-Costa, Claude Millot, Manuel F. Ruiz-López, 1996, J. Comput. Chem..

Molecular graphics and artificial intelligence in drug design: the SARAH system

Jean-Louis Rivail, Hervé Mathis, 1991 .

Quantum mechanical computations on very large molecular systems: The local self‐consistent field method

György G. Ferenczy, Jean-Louis Rivail, Daniel Rinaldi, 1994, J. Comput. Chem..

Analytical energy derivatives for a realistic continuum model of solvation: Application to the analysis of solvent effects on reaction paths

Jean-Louis Rivail, D. Rinaldi, J. Rivail, 1996 .

Reaction field factors for a multipole distribution in a cavity surrounded by a continuum

Jean-Louis Rivail, János G. Ángyán, D. Rinaldi, 1993 .

The Self-Consistent Reaction Field Model for Molecular Computations in Solution

Manuel F. Ruiz-López, Jean-Louis Rivail, Daniel Rinaldi, 1991 .

Ab initio SCF calculations on electrostatically solvated molecules using a deformable three axes ellipsoidal cavity

Manuel F. Ruiz-López, Jean-Louis Rivail, D. Rinaldi, 1983 .

Liquid-State Quantum Chemistry: Computational Applications of the Polarizable Continuum Models

Jean-Louis Rivail, D. Rinaldi, J. Rivail, 1996 .

A coupled density functional‐molecular mechanics Monte Carlo simulation method: The water molecule in liquid water

Claude Millot, Manuel F. Ruiz-López, Jean-Louis Rivail, 1996 .

MODELING OF PEPTIDE HYDROLYSIS BY THERMOLYSIN. A SEMIEMPIRICAL AND QM/MM STUDY

Manuel F. Ruiz-López, Jean-Louis Rivail, Serge Antonczak, 1998 .

Combined Quantum Mechanics and Molecular Mechanics Approaches to Chemical and Biochemical Reactivity

Manuel F. Ruiz-López, Jean-Louis Rivail, 2002 .

Quantum chemical computations on parts of large molecules: the ab initio local self consistent field method

Jean-Louis Rivail, Xavier Assfeld, J. Rivail, 1996 .

LIQUID-STATE QUANTUM CHEMISTRY : AN IMPROVED CAVITY MODEL

Jean-Louis Rivail, D. Rinaldi, J. Rivail, 1994 .

NDDO fragment self‐consistent field approximation for large electronic systems

György G. Ferenczy, Jean-Louis Rivail, Gábor Náray-Szabó, 1992 .

Hybrid Quantum Mechanical/Molecular Mechanical Methods

Jean-Louis Rivail, 2004 .

Theoretical calculation of vibrational polarizabilities. An application to the study of conformational and solvent effects

Manuel F. Ruiz-López, Jean-Louis Rivail, D. Rinaldi, 1986 .

A quantum chemical approach to dielectric solvent effects in molecular liquids

Jean-Louis Rivail, D. Rinaldi, J. Rivail, 1976 .

A self-consistent reaction field model of solvation using distributed multipoles. I. Energy and energy derivatives.

Jean-Louis Rivail, Alain Bouchy, D. Rinaldi, 2004, The Journal of chemical physics.

HYBRID CLASSICAL QUANTUM FORCE FIELD FOR MODELING VERY LARGE MOLECULES

Jean-Louis Rivail, Vincent Théry, J. Rivail, 1996 .

Theoretical modeling of large molecular systems. Advances in the local self consistent field method for mixed quantum mechanics/molecular mechanics calculations.

Jean-Louis Rivail, Xavier Assfeld, Antonio Monari, 2013, Accounts of chemical research.