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authFullName_s : Georgios Archontis

Hybrid MC/MD for protein design

Eleni Michael , Savvas Polydorides , Thomas Simonson , Georgios Archontis
Journal of Chemical Physics, 2020, 153 (5), pp.054113. ⟨10.1063/5.0013320⟩
Journal articles hal-03664020v1

Simple models for nonpolar solvation: Parameterization and testing

Eleni Michael , Savvas Polydorides , Thomas Simonson , Georgios Archontis
Journal of Computational Chemistry, 2017, 38 (29), pp.2509-2519. ⟨10.1002/jcc.24910⟩
Journal articles hal-01955056v1

Predicting the acid/base behavior of proteins: a constant-pH Monte Carlo approach with generalized born solvent.

Alexey Aleksandrov , Savvas Polydorides , Georgios Archontis , Thomas Simonson
Journal of Physical Chemistry B, 2010, 114 (32), pp.10634-48. ⟨10.1021/jp104406x⟩
Journal articles hal-00765893v1

Computational protein design: The proteus software and selected applications.

Thomas Simonson , Thomas Gaillard , David Mignon , Marcel Schmidt Am Busch , Anne Lopes , et al.
Journal of Computational Chemistry, 2013, 34 (28), pp.2472-84. ⟨10.1002/jcc.23418⟩
Journal articles istex hal-00868677v1

Physics-Based Computational Protein Design: An Update

David Mignon , Karen Druart , Eleni Michael , Vaitea Opuu , Savvas Polydorides , et al.
Journal of Physical Chemistry A, 2020, 124 (51), pp.10637-10648. ⟨10.1021/acs.jpca.0c07605⟩
Journal articles hal-03252554v1