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Alkorta, Ibon, Villar, Hugo O., Cachau, Raul E. (1993) Conformational analysis of 2,3,6,7-tetrahydroazepines with implications for D1-selective benzazepines. Journal of Computational Chemistry, 14 (5). 571-578 doi:10.1002/jcc.540140510

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Reference TypeJournal (article/letter/editorial)
TitleConformational analysis of 2,3,6,7-tetrahydroazepines with implications for D1-selective benzazepines
JournalJournal of Computational Chemistry
AuthorsAlkorta, IbonAuthor
Villar, Hugo O.Author
Cachau, Raul E.Author
Year1993 (May)Volume14
Issue5
PublisherWiley
DOIdoi:10.1002/jcc.540140510Search in ResearchGate
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Mindat Ref. ID3146091Long-form Identifiermindat:1:5:3146091:8
GUID0
Full ReferenceAlkorta, Ibon, Villar, Hugo O., Cachau, Raul E. (1993) Conformational analysis of 2,3,6,7-tetrahydroazepines with implications for D1-selective benzazepines. Journal of Computational Chemistry, 14 (5). 571-578 doi:10.1002/jcc.540140510
Plain TextAlkorta, Ibon, Villar, Hugo O., Cachau, Raul E. (1993) Conformational analysis of 2,3,6,7-tetrahydroazepines with implications for D1-selective benzazepines. Journal of Computational Chemistry, 14 (5). 571-578 doi:10.1002/jcc.540140510
In(1993, May) Journal of Computational Chemistry Vol. 14 (5) Wiley

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Alkorta, Ibon, Villar, Hugo O., Perez, Juan J. (1993) Comparison of methods to estimate the free energy of solvation:Importance in the modulation of the affinity of 3-benzazepines for the D1receptor. Journal of Computational Chemistry, 14 (5). 620-626 doi:10.1002/jcc.540140514
Alkorta, Ibon, Villar, Hugo O., Arteca, Gustavo A. (1993) Comparative study betweenab initio and semiempirical electrostatic potentials on molecular surfaces. Journal of Computational Chemistry, 14 (5). 530-540 doi:10.1002/jcc.540140505
Alkorta, Ibon, Villar, Hugo O., Perez, Juan J. (1993) Effect of the basis set on the computation of molecular polarization. The Journal of Physical Chemistry, 97 (36). 9113-9119 doi:10.1021/j100138a008
Villar, Hugo O., Loew, Gilda H. (1990) A conformational study of cocaine and its diastereomers. Journal of Computational Chemistry, 11 (9). 1111-1118 doi:10.1002/jcc.540110915
Kantola, Angelina, Villar, Hugo O., Loew, Gilda H. (1991) Atom based parametrization for a conformationally dependent hydrophobic index. Journal of Computational Chemistry, 12 (6). 681-689 doi:10.1002/jcc.540120605
Yáñez, Manuel, Ortíz‐Chi, Filiberto, Merino, Gabriel, Alkorta, Ibon (2023) Dismantlement of ammonia upon interaction with Be n ( n  ≤ 10) clusters. Journal of Computational Chemistry, 44 (3) 159-167 doi:10.1002/jcc.26843
Alkorta, Ibon, Perez, Juan J., Villar, Hugo O. (1994) Molecular polarization maps as a tool for studies of intermolecular interactions and chemical reactivity. Journal of Molecular Graphics, 12 (1). 3-13 doi:10.1016/0263-7855(94)80002-2
(1993) Masthead. Journal of Computational Chemistry, 14 (5). doi:10.1002/jcc.540140501
Hardy, B.J., Sarko, A. (1993) Conformational analysis and molecular dynamics simulation of cellobiose and larger cellooligomers. Journal of Computational Chemistry, 14 (7). 831-847 doi:10.1002/jcc.540140709
Saunders, Martin, Jiménez-Vázquez, Hugo Alejandro (1993) Stochastic searches for lactone and cycloalkene conformers. Journal of Computational Chemistry, 14 (3). 330-348 doi:10.1002/jcc.540140308
Alkorta, Ibon, Elguero, Jose, Espinosa, Enrique, Mata, Ignasi, Molins, Elies (2003) Comparison of electron density properties in frozen and relaxed electronic distributions. Journal of Computational Chemistry, 24 (4). 416-421 doi:10.1002/jcc.10204
 
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