From atoms to biomolecules: a fruitful perspective
Cauët, E., Carette, T., Lauzin, C., Li, J. G., Loreau, J., Delsaut, M., Nazé, C., Verdebout, S., Vranckx, S., Godefroid, M., Liévin, J., Vaeck, N.
Published in Theoretical chemistry accounts (01.08.2012)
Published in Theoretical chemistry accounts (01.08.2012)
Get full text
Journal Article
Accurate ground-state potential energy surfaces of the C2H2-Kr and C2H2-Xe van der Waals complexes
Lauzin, C., Cauët, E., Demaison, J., Herman, M., Stoll, H., Liévin, J.
Published in Molecular physics (01.11.2012)
Published in Molecular physics (01.11.2012)
Get full text
Journal Article
Quantum mechanical calculations related to ionization and charge transfer in DNA
Cauet, E, Valiev, M, Weare, J H, Lievin, J
Published in Journal of physics. Conference series (01.01.2012)
Published in Journal of physics. Conference series (01.01.2012)
Get full text
Journal Article
Histidine−Aromatic Interactions in Proteins and Protein−Ligand Complexes: Quantum Chemical Study of X-ray and Model Structures
Cauët, Emilie, Rooman, Marianne, Wintjens, René, Liévin, Jacques, Biot, Christophe
Published in Journal of chemical theory and computation (01.05.2005)
Published in Journal of chemical theory and computation (01.05.2005)
Get full text
Journal Article
Accurate ground-state potential energy surfaces of the C 2 H 2 –Kr and C 2 H 2 –Xe van der Waals complexes
Lauzin, C., Cauët, E., Demaison, J., Herman, M., Stoll, H., Liévin, J.
Published in Molecular physics (01.11.2012)
Published in Molecular physics (01.11.2012)
Get full text
Journal Article
Linearizing Control of an Induction Motor Subjected to Parameter Variation
Cauet, Sébastien, Rambault, Laurent, Etien, Erik, Mehdi, Driss, Champenois, Gérard
Published in Electric power components and systems (01.07.2001)
Published in Electric power components and systems (01.07.2001)
Get full text
Journal Article
NWChem: Past, Present, and Future
Aprà, E, Bylaska, E J, de Jong, W A, Govind, N, Kowalski, K, Straatsma, T P, Valiev, M, H J J van Dam, Alexeev, Y, Anchell, J, Anisimov, V, Aquino, F W, Atta-Fynn, R, Autschbach, J, Bauman, N P, Bernholdt, D E, Bogatko, S, Borowski, P, Boschen, J, Brabec, J, Bruner, A, Cauët, E, Cramer, C J, Daily, J, Deegan, M J O, Dyall, K G, Fann, G I, Fischer, S A, Fonari, A, Gagliardi, L, Garza, J, Gawande, N, Glaesemann, K, Götz, A W, Hammond, J, Helms, V, Hermes, E D, Hirao, K, Hirata, S, Jacquelin, M, Jónsson, H, Kendall, R A, Klemm, M, Konkov, V, Krishnamoorthy, S, Krishnan, M, Lin, Z, Lins, R D, Littlefield, R J, Logsdail, A J, Lopata, K, W Ma, Marenich, A V, Martin del Campo, J, Mejia-Rodriguez, D, Moore, J E, Mullin, J M, Nichols, J A, Nichols, P J, Nieplocha, J, A Otero de la Roza, Palmer, B, Panyala, A, Pirojsirikul, T, Peng, B, Peverati, R, Pittner, J, Pollack, L, Richard, R M, Sadayappan, P, Schatz, G C, Shelton, W A, Silverstein, D W, Smith, D M A, Soares, T A, Song, D, Swart, M, Taylor, H L, Thomas, G S, Tipparaju, V, Truhlar, D G, Tsemekhman, K, T Van Voorhis, Verma, P, Villa, O, Vishnu, A, Vogiatzis, K D, Wang, D, Weare, J H, Williamson, M J, Windus, T L, Woliński, K, Wong, A T, Q Wu, Yang, C, Q Yu, Zacharias, M, Zhang, Z, Zhao, Y, Harrison, R J
Published in arXiv.org (26.05.2020)
Published in arXiv.org (26.05.2020)
Get full text
Paper
Journal Article