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5 résultats
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triés par
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Mathematical Analysis and Calculation of Molecular SurfacesJournal of Computational Physics, 2016, ⟨10.1016/j.jcp.2016.07.007⟩
Article dans une revue
hal-01205580v2
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A BOUNDARY-PARTITION-BASED DIAGRAM OF D-DIMENSIONAL BALLS: DEFINITION, PROPERTIES AND APPLICATIONS2019
Pré-publication, Document de travail
hal-01883443v2
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NCIPLOT4: fast, robust and quantitative analysis of noncovalent interactionsJournal of Chemical Theory and Computation, 2020, ⟨10.1021/acs.jctc.0c00063⟩
Article dans une revue
hal-02377999v1
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Meshing molecular surfaces based on analytical implicit representationJournal of Molecular Graphics and Modelling, 2017, 71, pp.200-210. ⟨10.1016/j.jmgm.2016.11.008⟩
Article dans une revue
hal-01248532v2
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NCIPLOT and the analysis of noncovalent interactions using the reduced density gradientWIREs Computational Molecular Science, 2021, 11 (2), pp.e1497. ⟨10.1002/wcms.1497⟩
Article dans une revue
hal-02921299v1
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