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Journal Articles
- 2020
[j7]Sohvi Luukkonen
, Luc Belloni, Daniel Borgis, Maximilien Levesque:
Predicting Hydration Free Energies of the FreeSolv Database of Drug-like Molecules with Molecular Density Functional Theory. J. Chem. Inf. Model. 60(7): 3558-3565 (2020)- 2013
- [j6]Michel Masella, Daniel Borgis, Philippe Cuniasse:
A multiscale coarse-grained polarizable solvent model for handling long tail bulk electrostatics. J. Comput. Chem. 34(13): 1112-1124 (2013) - 2011
- [j5]Michel Masella, Daniel Borgis, Philippe Cuniasse:
Combining a polarizable force-field and a coarse-grained polarizable solvent model. II. Accounting for hydrophobic effects. J. Comput. Chem. 32(12): 2664-2678 (2011) - 2009
- [j4]M. Souaille, H. Loirat, Daniel Borgis, Marie-Pierre Gaigeot:
MDVRY: a polarizable classical molecular dynamics package for biomolecules. Comput. Phys. Commun. 180(2): 276-301 (2009) - 2008
- [j3]Michel Masella, Daniel Borgis, Philippe Cuniasse:
Combining a polarizable force-field and a coarse-grained polarizable solvent model: Application to long dynamics simulations of bovine pancreatic trypsin inhibitor. J. Comput. Chem. 29(11): 1707-1724 (2008) - 2005
- [j2]Nicolas Levy, Daniel Borgis, Massimo Marchi:
A dielectric continuum model of solvation for complex solutes. Comput. Phys. Commun. 169(1-3): 69-74 (2005) - 2004
- [j1]Nathalie Basdevant, Daniel Borgis, Tâp Ha-Duong:
A semi-implicit solvent model for the simulation of peptides and proteins. J. Comput. Chem. 25(8): 1015-1029 (2004)
Coauthor Index
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