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FMOxFMO: Elucidating Excitonic Interactions in the Fenna-Matthews-Olson Complex with the Fragment Molecular Orbital Method.
Kaliakin, Danil S; Nakata, Hiroya; Kim, Yongbin; Chen, Qifeng; Fedorov, Dmitri G; Slipchenko, Lyudmila V.
Afiliação
  • Kaliakin DS; Department of Chemistry , Purdue University , 560 Oval Drive , West Lafayette , Indiana 47907 , United States.
  • Nakata H; Research Institute for Advanced Materials and Devices , Kyocera , 5-3 Hikaridai-3 , Seika-cho Soraku-gun, Kyoto 619-0237 , Japan.
  • Kim Y; Department of Chemistry , Purdue University , 560 Oval Drive , West Lafayette , Indiana 47907 , United States.
  • Chen Q; Department of Chemistry , Purdue University , 560 Oval Drive , West Lafayette , Indiana 47907 , United States.
  • Fedorov DG; Research Center for Computational Design of Advanced Functional Materials (CD-FMat) , National Institute of Advanced Industrial Science and Technology (AIST) , Central 2, Umezono 1-1-1 , Tsukuba 305-8568 , Japan.
  • Slipchenko LV; Department of Chemistry , Purdue University , 560 Oval Drive , West Lafayette , Indiana 47907 , United States.
J Chem Theory Comput ; 16(2): 1175-1187, 2020 Feb 11.
Article em En | MEDLINE | ID: mdl-31841349
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Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Assunto principal: Teoria Quântica / Proteínas de Bactérias / Modelos Moleculares / Complexos de Proteínas Captadores de Luz Idioma: En Revista: J Chem Theory Comput Ano de publicação: 2020 Tipo de documento: Article
Texto completo
Imprimir
XML
PubMed Links
Buscar no Google

Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Assunto principal: Teoria Quântica / Proteínas de Bactérias / Modelos Moleculares / Complexos de Proteínas Captadores de Luz Idioma: En Revista: J Chem Theory Comput Ano de publicação: 2020 Tipo de documento: Article