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Damme, Sofie Van, Bultinck, Patrick (2007) A new computer program for QSAR-analysis: ARTE-QSAR. Journal of Computational Chemistry, 28 (11). 1924-1928 doi:10.1002/jcc.20664

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Reference TypeJournal (article/letter/editorial)
TitleA new computer program for QSAR-analysis: ARTE-QSAR
JournalJournal of Computational Chemistry
AuthorsDamme, Sofie VanAuthor
Bultinck, PatrickAuthor
Year2007 (August)Volume28
Issue11
PublisherWiley
DOIdoi:10.1002/jcc.20664Search in ResearchGate
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Mindat Ref. ID3148797Long-form Identifiermindat:1:5:3148797:9
GUID0
Full ReferenceDamme, Sofie Van, Bultinck, Patrick (2007) A new computer program for QSAR-analysis: ARTE-QSAR. Journal of Computational Chemistry, 28 (11). 1924-1928 doi:10.1002/jcc.20664
Plain TextDamme, Sofie Van, Bultinck, Patrick (2007) A new computer program for QSAR-analysis: ARTE-QSAR. Journal of Computational Chemistry, 28 (11). 1924-1928 doi:10.1002/jcc.20664
In(2007, August) Journal of Computational Chemistry Vol. 28 (11) Wiley

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Van Damme, Sofie, Bultinck, Patrick (2009) Conceptual DFT properties-based 3D QSAR: Analysis of inhibitors of the nicotine metabolizing CYP2A6 enzyme. Journal of Computational Chemistry, 30 (12). 1749-1757 doi:10.1002/jcc.21177
Van Damme, Sofie, Bultinck, Patrick (2010) 3D QSAR based on conceptual DFT molecular fields: Antituberculotic activity. Journal of Molecular Structure: THEOCHEM, 943. 83-89 doi:10.1016/j.theochem.2009.10.031
Bultinck, Patrick, Van Damme, Sofie, Cedillo, Andrés (2013) Bond fukui indices: Comparison of frozen molecular orbital and finite differences through mulliken populations. Journal of Computational Chemistry, 34 (28). 2421-2429 doi:10.1002/jcc.23405
Fias, Stijn, Van Damme, Sofie, Bultinck, Patrick (2008) Multidimensionality of delocalization indices and nucleus independent chemical shifts in polycyclic aromatic hydrocarbons. Journal of Computational Chemistry, 29 (3). 358-366 doi:10.1002/jcc.20794
Acke, Guillaume, Van Damme, Sofie, Havenith, Remco W. A., Bultinck, Patrick (2018) Interpreting the behavior of the NICSzz by resolving in orbitals, sign, and positions. Journal of Computational Chemistry, 39 (9). 511-519 doi:10.1002/jcc.25095
Bultinck, Patrick, Ponec, Robert, Van Damme, Sofie (2005) Multicenter bond indices as a new measure of aromaticity in polycyclic aromatic hydrocarbons. Journal of Physical Organic Chemistry, 18 (8). 706-718 doi:10.1002/poc.922
Bultinck, Patrick, Ponec, Robert, Carbó-Dorca, Ramon (2007) Aromaticity in linear polyacenes: Generalized population analysis and molecular quantum similarity approach. Journal of Computational Chemistry, 28 (1). 152-160 doi:10.1002/jcc.20491
Daré, Joyce K., Freitas, Matheus P. (2022) Is conformation relevant for QSAR purposes? 2D Chemical representation in a 3D‐QSAR perspective. Journal of Computational Chemistry, 43 (13) 917-922 doi:10.1002/jcc.26848
Zhou, Congyi, Nie, Changming, Li, Shan, Li, Zhonghai (2007) A novel semi-empirical topological descriptorNtand the application to study on QSPR/QSAR. Journal of Computational Chemistry, 28 (15). 2413-2423 doi:10.1002/jcc.20540
Bultinck, Patrick, Augustynen, Stijn, Hilbers, Hans W., Moret, Ed E., Tollenaere, Jan P. (2002) Generate: A program for 3-D structure generation and conformational analysis of peptides and peptidomimetics. Journal of Computational Chemistry, 23 (7). 746-754 doi:10.1002/jcc.10081
Gramatica, Paola, Chirico, Nicola, Papa, Ester, Cassani, Stefano, Kovarich, Simona (2013) QSARINS: A new software for the development, analysis, and validation of QSAR MLR models. Journal of Computational Chemistry, 34 (24). 2121-2132 doi:10.1002/jcc.23361
 
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