Molecular mechanics application in inorganic Chemistry

Detalhes bibliográficos
Autor(a) principal: Coelho,Lilian Weitzel
Data de Publicação: 1999
Outros Autores: Junqueira,Georgia Maria Amaral, Machuca Herrera,Juan Omar, Machado,Sérgio de Paula, Machado,Bianca da Cunha
Tipo de documento: Artigo
Idioma: eng
Título da fonte: Química Nova (Online)
Texto Completo: http://old.scielo.br/scielo.php?script=sci_arttext&pid=S0100-40421999000300018
Resumo: The present paper is a review about basic principles of the molecular mechanics that is the most important tool used in molecular modeling area, and their applications to the calculation of the relative stability and chemical reactivity of organometalic and coordination compounds. We show how molecular mechanics can be successfully applied to a wide variety of inorganic systems.
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spelling Molecular mechanics application in inorganic Chemistrymolecular mechanicscoordination compoundstrans effectThe present paper is a review about basic principles of the molecular mechanics that is the most important tool used in molecular modeling area, and their applications to the calculation of the relative stability and chemical reactivity of organometalic and coordination compounds. We show how molecular mechanics can be successfully applied to a wide variety of inorganic systems.Sociedade Brasileira de Química1999-06-01info:eu-repo/semantics/articleinfo:eu-repo/semantics/publishedVersiontext/htmlhttp://old.scielo.br/scielo.php?script=sci_arttext&pid=S0100-40421999000300018Química Nova v.22 n.3 1999reponame:Química Nova (Online)instname:Sociedade Brasileira de Química (SBQ)instacron:SBQ10.1590/S0100-40421999000300018info:eu-repo/semantics/openAccessCoelho,Lilian WeitzelJunqueira,Georgia Maria AmaralMachuca Herrera,Juan OmarMachado,Sérgio de PaulaMachado,Bianca da Cunhaeng2000-05-03T00:00:00Zoai:scielo:S0100-40421999000300018Revistahttps://www.scielo.br/j/qn/ONGhttps://old.scielo.br/oai/scielo-oai.phpquimicanova@sbq.org.br1678-70640100-4042opendoar:2000-05-03T00:00Química Nova (Online) - Sociedade Brasileira de Química (SBQ)false
dc.title.none.fl_str_mv Molecular mechanics application in inorganic Chemistry
title Molecular mechanics application in inorganic Chemistry
spellingShingle Molecular mechanics application in inorganic Chemistry
Coelho,Lilian Weitzel
molecular mechanics
coordination compounds
trans effect
title_short Molecular mechanics application in inorganic Chemistry
title_full Molecular mechanics application in inorganic Chemistry
title_fullStr Molecular mechanics application in inorganic Chemistry
title_full_unstemmed Molecular mechanics application in inorganic Chemistry
title_sort Molecular mechanics application in inorganic Chemistry
author Coelho,Lilian Weitzel
author_facet Coelho,Lilian Weitzel
Junqueira,Georgia Maria Amaral
Machuca Herrera,Juan Omar
Machado,Sérgio de Paula
Machado,Bianca da Cunha
author_role author
author2 Junqueira,Georgia Maria Amaral
Machuca Herrera,Juan Omar
Machado,Sérgio de Paula
Machado,Bianca da Cunha
author2_role author
author
author
author
dc.contributor.author.fl_str_mv Coelho,Lilian Weitzel
Junqueira,Georgia Maria Amaral
Machuca Herrera,Juan Omar
Machado,Sérgio de Paula
Machado,Bianca da Cunha
dc.subject.por.fl_str_mv molecular mechanics
coordination compounds
trans effect
topic molecular mechanics
coordination compounds
trans effect
description The present paper is a review about basic principles of the molecular mechanics that is the most important tool used in molecular modeling area, and their applications to the calculation of the relative stability and chemical reactivity of organometalic and coordination compounds. We show how molecular mechanics can be successfully applied to a wide variety of inorganic systems.
publishDate 1999
dc.date.none.fl_str_mv 1999-06-01
dc.type.driver.fl_str_mv info:eu-repo/semantics/article
dc.type.status.fl_str_mv info:eu-repo/semantics/publishedVersion
format article
status_str publishedVersion
dc.identifier.uri.fl_str_mv http://old.scielo.br/scielo.php?script=sci_arttext&pid=S0100-40421999000300018
url http://old.scielo.br/scielo.php?script=sci_arttext&pid=S0100-40421999000300018
dc.language.iso.fl_str_mv eng
language eng
dc.relation.none.fl_str_mv 10.1590/S0100-40421999000300018
dc.rights.driver.fl_str_mv info:eu-repo/semantics/openAccess
eu_rights_str_mv openAccess
dc.format.none.fl_str_mv text/html
dc.publisher.none.fl_str_mv Sociedade Brasileira de Química
publisher.none.fl_str_mv Sociedade Brasileira de Química
dc.source.none.fl_str_mv Química Nova v.22 n.3 1999
reponame:Química Nova (Online)
instname:Sociedade Brasileira de Química (SBQ)
instacron:SBQ
instname_str Sociedade Brasileira de Química (SBQ)
instacron_str SBQ
institution SBQ
reponame_str Química Nova (Online)
collection Química Nova (Online)
repository.name.fl_str_mv Química Nova (Online) - Sociedade Brasileira de Química (SBQ)
repository.mail.fl_str_mv quimicanova@sbq.org.br
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