Zobrazeno 1 - 10 of 10 pro vyhledávání: '"Ottou Abe, Martin Thierry"'
1
Dissertation/ Thesis
Étude par simulation de dynamique moléculaire de la structure et de la mobilité moléculaire de matériaux complexes d'intérêt thérapeutique
Autor: Ottou Abe, Martin Thierry
Les matériaux moléculaires vitrifiables présentent généralement des mobilités complexes incluant plusieurs relaxations non-exponentielles (non - Debye) comme le montre la spectroscopie de relaxation diélectrique. Une relaxation de type Debye e
Externí odkaz: http://www.theses.fr/2014LIL10042/document
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2
Applications of molecular modelling on crystallization/vitrification issues of pharmaceuticals Impact of chirality on ibuprofen physical properties in the amorphous states
Autor: Affouard, Frederic, T. Correia, Natália, Viciosa, María Teresa, Ottou Abe, Martin Thierry
Publikováno v: 1st International Conference on Contemporary Pharmacy Challenges (1 ICCPC) Amorphous Pharmaceuticals and Biopharmaceuticals
1st International Conference on Contemporary Pharmacy Challenges (1 ICCPC) Amorphous Pharmaceuticals and Biopharmaceuticals, Sep 2018, Wisla, Poland
International audience
Externí odkaz: https://explore.openaire.eu/search/publication?articleId=dedup_wf_001::2f7fca3ab5b84cfec61e6e6bb731a5b6
https://hal.univ-lille.fr/hal-02160197
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4
HYDROGEN BONDING LIQUIDS OF PHARMACEUTICAL INTEREST: INSIGHTS FROM MOLECULAR DYNAMICS SIMULATIONS
Autor: Ottou Abe, Martin Thierry, T. Correia, Natália, Affouard, Frédéric
Publikováno v: 1er colloque Français sur la Spectroscopie Diélectrique appliquée aux Matériaux
1er colloque Français sur la Spectroscopie Diélectrique appliquée aux Matériaux, Jun 2017, Rouen, France
National audience
Externí odkaz: https://explore.openaire.eu/search/publication?articleId=dedup_wf_001::708e9fe2c14d5df7d8b8470f1f55ba4b
https://hal.univ-lille.fr/hal-02161432
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5
Comparative study of ibuprofen, ketoprofen and flurbiprofen in the liquid state by molecular modelling
Autor: Affouard, Frederic, T. Correia, Natália, Valdes, Laurent, Ndjaka, J.M.B., Ottou Abe, Martin Thierry
Publikováno v: AMPTEC 2014 (Advanced Materials and Pharmaceutical TEChnologies)
AMPTEC 2014 (Advanced Materials and Pharmaceutical TEChnologies), Jul 2014, Villeneuve d'Ascq, France
International audience
Externí odkaz: https://explore.openaire.eu/search/publication?articleId=dedup_wf_001::82d41dcee364b9d4b1947d78db9de908
https://hal.univ-lille.fr/hal-02161357
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6
Pharmaceuticals : insights from molecular modeling
Autor: Affouard, Frédéric, Dubois, Rémy, Ottou Abe, Martin Thierry, T. Correia, Natália, Valdes, Laurent, Descamps, Marc
Publikováno v: Workshop on stability of amorphous materials
Workshop on stability of amorphous materials, Oct 2013, Castiglioncello, Italy
International audience
Externí odkaz: https://explore.openaire.eu/search/publication?articleId=dedup_wf_001::e1f76bbba565ee8ce186c0d52d62c04d
https://hal.univ-lille.fr/hal-02170762
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7
Molecular dynamics simulation of ibuprofen, ketoprofen and flurbiprofen in the liquid state
Autor: Affouard, Frederic, T. Correia, Natália, Ndjaka, J.M.B., Valdes, Laurent, Ottou Abe, Martin Thierry
Publikováno v: European/Japanese Molecular Liquids Group) annual meeting 2013
European/Japanese Molecular Liquids Group) annual meeting 2013, Sep 2013, Villeneuve d'Ascq, France
International audience
Externí odkaz: https://explore.openaire.eu/search/publication?articleId=od______4254::49b4862250be4c1ae91e98ed7a6f288f
https://hal.univ-lille.fr/hal-02161392
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8
Debye peak in molecular glass-forming liquids: Insights from molecular dynamics simulations
Autor: Affouard, Frédéric, T. Correia, Natália, Ottou Abe, Martin Thierry, Valdes, Laurent
Publikováno v: 7th International Discussion Meeting on Relaxations in Complex Systems
7th International Discussion Meeting on Relaxations in Complex Systems, Jul 2013, Barcelone, Spain
International audience
Externí odkaz: https://explore.openaire.eu/search/publication?articleId=dedup_wf_001::33b7293c9645bf518f397be57fec8d8a
https://hal.univ-lille.fr/hal-02161366
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10
Akademický článek
Impact of chirality on peculiar ibuprofen molecular dynamics: hydrogen bonding organization and syn vs. anti carboxylic group conformations.
Autor: Ottou Abe, Martin Thierry, Viciosa, María Teresa, Correia, Natália T., Affouard, Frédéric
Publikováno v: Physical Chemistry Chemical Physics (PCCP); 12/14/2018, Vol. 20 Issue 46, p29528-29538, 11p
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