Zobrazeno 1 - 10 of 148 pro vyhledávání: '"Melaccio, F."'
1
Akademický článek
QM/MM Investigation of the Spectroscopic Properties of the Fluorophore of Bacterial Luciferase.
Autor: Giuliani G; Department of Biotechnology, Chemistry and Pharmacy, University of Siena, Via A. Moro 2, 53100 Siena, Italy., Melaccio F; Department of Biotechnology, Chemistry and Pharmacy, University of Siena, Via A. Moro 2, 53100 Siena, Italy., Gozem S; Department of Chemistry, Georgia State University, Atlanta, Georgia 30302, United States., Cappelli A; Department of Biotechnology, Chemistry and Pharmacy, University of Siena, Via A. Moro 2, 53100 Siena, Italy., Olivucci M; Department of Biotechnology, Chemistry and Pharmacy, University of Siena, Via A. Moro 2, 53100 Siena, Italy.; Department of Chemistry, Bowling Green State University, Bowing Green, Ohio 43403, United States.
Publikováno v: Journal of chemical theory and computation [J Chem Theory Comput] 2021 Feb 09; Vol. 17 (2), pp. 605-613. Date of Electronic Publication: 2021 Jan 15.
Zobrazit plný text záznamu
4
Akademický článek
In-silico predicted mouse melanopsins with blue spectral shifts deliver efficient subcellular signaling.
Autor: Wijayaratna, Dhanushan1 (AUTHOR), Sacchetta, Filippo2 (AUTHOR), Pedraza-González, Laura3 (AUTHOR), Fanelli, Francesca4 (AUTHOR), Sugihara, Tomohiro5 (AUTHOR), Koyanagi, Mitsumasa5,6 (AUTHOR), Piyawardana, Senuri1 (AUTHOR), Ghotra, Kiran7 (AUTHOR), Thotamune, Waruna1 (AUTHOR), Terakita, Akihisa5,6 (AUTHOR), Olivucci, Massimo2,8 (AUTHOR) olivucci@unisi.it, Karunarathne, Ajith1 (AUTHOR) wkarunarathne@slu.edu
Publikováno v: Cell Communication & Signaling. 8/8/2024, Vol. 22 Issue 1, p1-22. 22p.
Zobrazit plný text záznamu
5
Unique QM/MM Potential Energy Surface Exploration Using Microiterations
Autor: Melaccio, F, Olivucci, Massimo, Lindh, R, Ferre, N.
Publikováno v: International Journal of Quantum Chemistry
International Journal of Quantum Chemistry, Wiley, 2011, 111 (13), pp.3339--3346. ⟨10.1002/qua.23067⟩
International Journal of Quantum Chemistry, 2011, 111 (13), pp.3339--3346. ⟨10.1002/qua.23067⟩
WOS:000295110300016; International audience; The determination and the characterization of important points of a potential energy surface can be carried out routinely using any molecular modelling software based on either a quantum mechanical (QM) or
Externí odkaz: https://explore.openaire.eu/search/publication?articleId=dedup_wf_001::d0faed51db313e7b3b008db10d4ac01d
https://hal-amu.archives-ouvertes.fr/hal-01415208
Zobrazit plný text záznamu
7
Akademický článek
Tento výsledek nelze pro nepřihlášené uživatele zobrazit.
K zobrazení výsledku je třeba se přihlásit.
8
Akademický článek
An Average Solvent Electrostatic Configuration Protocol for QM/MM Free Energy Optimization: Implementation and Application to Rhodopsin Systems.
Autor: Orozco-Gonzalez Y; Université de Strasbourg-CNRS, UMR 7504, Institut de Physique et Chimie des Mateŕiaux de Strasbourg , F-67034 Strasbourg, France.; USIAS Institut d'É;tudes Avanceés, Université de Strasbourg , 5 alleé du Geńeŕal Rouvillois, F-67083 Strasbourg, France.; Department of Chemistry, Bowling Green State University , Bowling Green, Ohio 43403, United States., Manathunga M; Department of Chemistry, Bowling Green State University , Bowling Green, Ohio 43403, United States., Marín MDC; Department of Biotechnology, Chemistry e Pharmacy, Università di Siena , via A. Moro 2, I-53100 Siena, Italy., Agathangelou D; Université de Strasbourg-CNRS, UMR 7504, Institut de Physique et Chimie des Mateŕiaux de Strasbourg , F-67034 Strasbourg, France., Jung KH; Department of Life Science and Institute of Biological Interfaces, Sogang University 35 Baekbeom-Ro , Mapo-Gu, Seoul 04107, Korea., Melaccio F; Department of Biotechnology, Chemistry e Pharmacy, Università di Siena , via A. Moro 2, I-53100 Siena, Italy., Ferré N; Aix-Marseille Univ, CNRS, ICR , 13013 Marseille, France., Haacke S; Université de Strasbourg-CNRS, UMR 7504, Institut de Physique et Chimie des Mateŕiaux de Strasbourg , F-67034 Strasbourg, France., Coutinho K; Instituto de Física, Universidade de São Paulo , 05508-090 Cidade Universitária, São Paulo/SP, Brazil., Canuto S; Instituto de Física, Universidade de São Paulo , 05508-090 Cidade Universitária, São Paulo/SP, Brazil., Olivucci M; Université de Strasbourg-CNRS, UMR 7504, Institut de Physique et Chimie des Mateŕiaux de Strasbourg , F-67034 Strasbourg, France.; USIAS Institut d'É;tudes Avanceés, Université de Strasbourg , 5 alleé du Geńeŕal Rouvillois, F-67083 Strasbourg, France.; Department of Chemistry, Bowling Green State University , Bowling Green, Ohio 43403, United States.; Department of Biotechnology, Chemistry e Pharmacy, Università di Siena , via A. Moro 2, I-53100 Siena, Italy.
Publikováno v: Journal of chemical theory and computation [J Chem Theory Comput] 2017 Dec 12; Vol. 13 (12), pp. 6391-6404. Date of Electronic Publication: 2017 Nov 21.
Zobrazit plný text záznamu
9
Akademický článek
Toward Automatic Rhodopsin Modeling as a Tool for High-Throughput Computational Photobiology.
Autor: Melaccio F; Department of Biotechnology, Chemistry e Pharmacy, Università di Siena , via A. Moro 2, I-53100 Siena, Italy., Del Carmen Marín M; Department of Biotechnology, Chemistry e Pharmacy, Università di Siena , via A. Moro 2, I-53100 Siena, Italy.; Department of Chemistry, Bowling Green State University , Bowling Green, Ohio 43403, United States., Valentini A; Department of Biotechnology, Chemistry e Pharmacy, Università di Siena , via A. Moro 2, I-53100 Siena, Italy., Montisci F; Department of Biotechnology, Chemistry e Pharmacy, Università di Siena , via A. Moro 2, I-53100 Siena, Italy., Rinaldi S; Department of Biotechnology, Chemistry e Pharmacy, Università di Siena , via A. Moro 2, I-53100 Siena, Italy., Cherubini M; Department of Biotechnology, Chemistry e Pharmacy, Università di Siena , via A. Moro 2, I-53100 Siena, Italy., Yang X; Department of Chemistry, Bowling Green State University , Bowling Green, Ohio 43403, United States., Kato Y; Department of Frontier Materials, Graduate School of Engineering, Nagoya Institute of Technology , Gokiso-cho, Showa-ku, Nagoya, Japan., Stenrup M; Aix-Marseille Université , CNRS, ICR, 13284 Marseille, France., Orozco-Gonzalez Y; Department of Chemistry, Bowling Green State University , Bowling Green, Ohio 43403, United States.; Institut de Physique et Chimie des Matériaux de Strasbourg, UMR 7504 Université de Strasbourg-CNRS , F-67034 Strasbourg, France.; USIAS Institut d'Études Avancées, Université de Strasbourg , 5 allée du Général Rouvillois, F-67083 Strasbourg, France., Ferré N; Aix-Marseille Université , CNRS, ICR, 13284 Marseille, France., Luk HL; Department of Chemistry, Bowling Green State University , Bowling Green, Ohio 43403, United States., Kandori H; Department of Frontier Materials, Graduate School of Engineering, Nagoya Institute of Technology , Gokiso-cho, Showa-ku, Nagoya, Japan., Olivucci M; Department of Biotechnology, Chemistry e Pharmacy, Università di Siena , via A. Moro 2, I-53100 Siena, Italy.; Department of Chemistry, Bowling Green State University , Bowling Green, Ohio 43403, United States.; Institut de Physique et Chimie des Matériaux de Strasbourg, UMR 7504 Université de Strasbourg-CNRS , F-67034 Strasbourg, France.; USIAS Institut d'Études Avancées, Université de Strasbourg , 5 allée du Général Rouvillois, F-67083 Strasbourg, France.
Publikováno v: Journal of chemical theory and computation [J Chem Theory Comput] 2016 Dec 13; Vol. 12 (12), pp. 6020-6034. Date of Electronic Publication: 2016 Nov 15.
Zobrazit plný text záznamu
10
Akademický článek
Modulation of thermal noise and spectral sensitivity in Lake Baikal cottoid fish rhodopsins.
Autor: Luk HL; Chemistry Department, Bowling Green State University, Bowling Green OH 43403, USA., Bhattacharyya N; Department of Ecology and Evolutionary Biology and Department of Cell and Systems Biology, University of Toronto, 25 Harbord St., Toronto, ON M5S 3G5, Canada., Montisci F; Dipartimento di Biotecnologie, Chimica e Farmacia, Università di Siena, Siena, I-53100, Italy., Morrow JM; Department of Ecology and Evolutionary Biology and Department of Cell and Systems Biology, University of Toronto, 25 Harbord St., Toronto, ON M5S 3G5, Canada., Melaccio F; Dipartimento di Biotecnologie, Chimica e Farmacia, Università di Siena, Siena, I-53100, Italy., Wada A; Department of Organic Chemistry for Life Science, Kobe Pharmaceutical University, 4-19-1 Motoyamakita-machi, Higashinada-ku, Kobe 658-8558, Japan., Sheves M; Department of Organic Chemistry, Weizman Institute of Science, 234 Herzl Street, Rehovot 7610001, Israel., Fanelli F; Department of Life Sciences, University of Modena and Reggio Emilia, I-41125 Modena, Italy., Chang BS; Department of Ecology and Evolutionary Biology and Department of Cell and Systems Biology, University of Toronto, 25 Harbord St., Toronto, ON M5S 3G5, Canada., Olivucci M; Chemistry Department, Bowling Green State University, Bowling Green OH 43403, USA.; Dipartimento di Biotecnologie, Chimica e Farmacia, Università di Siena, Siena, I-53100, Italy.
Publikováno v: Scientific reports [Sci Rep] 2016 Dec 09; Vol. 6, pp. 38425. Date of Electronic Publication: 2016 Dec 09.
Zobrazit plný text záznamu

Vyhledávací nástroje:

Upřesnit hledání

Omezení vyhledávání
Plný text Recenzováno Digitální knihovna AV ČR
Zdroje