CV

Ludovic Chaput, Edithe Selwa, Eddy Elisée, Bogdan Iorga. Blinded evaluation of cathepsin S inhibitors from the D3RGC3 dataset using molecular docking and free energy calculations. Journal of Computer-Aided Molecular Design, Springer Verlag, 2019, 33 (1), pp.93-103. ⟨10.1007/s10822-018-0161-7⟩. ⟨hal-02119834⟩

Eddy Elisée, Vytautas Gapsys, Nawel Mele, Ludovic Chaput, Edithe Selwa, et al.. Performance evaluation of molecular docking and free energy calculations protocols using the D3R Grand Challenge 4 dataset. Journal of Computer-Aided Molecular Design, Springer Verlag, 2019, 33 (12), pp.1031-1043. ⟨10.1007/s10822-019-00232-w⟩. ⟨hal-02346257⟩

Xiao Xie, Oksana Reznichenko, Ludovic Chaput, Pascal G.P. Martin, Marie-Paule Teulade-Fichou, et al.. Topology-Selective Fluorescent "Light-Up" Probes for G-Quadruplex DNA Based on Photoinduced Electron Transfer. Chemistry - A European Journal, Wiley-VCH Verlag, 2018, ⟨10.1002/chem.201801701⟩. ⟨hal-01821778⟩

Ludovic Chaput, Zsuzsanna Marton, Philippe Pineau, Lisiane Domon, Vinh Tran, et al.. Enhancing the enantioselectivity of CALB by substrate imprinting: A combined experimental and molecular dynamics simulation model study. Journal of Molecular Catalysis B: Enzymatic, Elsevier, 2012, 84, pp.55-61. ⟨hal-00789671⟩

Zsuzsanna Marton, Ludovic Chaput, Guillaume Pierre, Marianne Graber. Lipase hydration state in the gas phase: Sorption isotherm measurements and inverse gas chromatography. Biotechnology Journal, Wiley-VCH Verlag, 2010, 5 (11), pp.1216. ⟨10.1002/biot.201000272⟩. ⟨hal-00590750⟩

Ludovic Chaput. Compréhension de l'énantiosélectivité de la lipase B de Candida antarctica : étude par modélisation moléculaire et expérimentation. Sciences agricoles. Université de La Rochelle, 2012. Français. ⟨NNT : 2012LAROS371⟩. ⟨tel-00825876⟩