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1
A general method to describe intersystem crossing dynamics in trajectory surface hopping
A general method to describe intersystem crossing dynamics in trajectory surface hopping
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A general method to describe intersystem crossing dynamics in trajectory surface hopping

Mai, Sebastian ; Marquetand, Philipp ; González, Leticia

International journal of quantum chemistry, 2015-09, Vol.115 (18), p.1215-1231 [Periódico revisado por pares]

Hoboken: Blackwell Publishing Ltd

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2
Effects of different initial condition samplings on photodynamics and spectrum of pyrrole
Effects of different initial condition samplings on photodynamics and spectrum of pyrrole
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Effects of different initial condition samplings on photodynamics and spectrum of pyrrole

Barbatti, Mario ; Sen, Kakali

International journal of quantum chemistry, 2016-05, Vol.116 (10), p.762-771 [Periódico revisado por pares]

Hoboken: Blackwell Publishing Ltd

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3
Color-Discriminating Retinal Configurations of Sensory RhodopsinI by Photo-Irradiation Solid-State NMR Spectroscopy
Color-Discriminating Retinal Configurations of Sensory RhodopsinI by Photo-Irradiation Solid-State NMR Spectroscopy
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Color-Discriminating Retinal Configurations of Sensory RhodopsinI by Photo-Irradiation Solid-State NMR Spectroscopy

Yomoda, Hiroki ; Makino, Yoshiteru ; Tomonaga, Yuya ; Hidaka, Tetsurou ; Kawamura, Izuru ; Okitsu, Takashi ; Wada, Akimori ; Sudo, Yuki ; Naito, Akira

Angewandte Chemie, 2014-07, Vol.126 (27), p.7080-7084 [Periódico revisado por pares]

Weinheim: Wiley Subscription Services, Inc

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4
A Short Synthesis of (±)‐3‐Demethoxyerythratidinone by Ligand‐Controlled Selective Heck Cyclization of Equilibrating Enamines
A Short Synthesis of (±)‐3‐Demethoxyerythratidinone by Ligand‐Controlled Selective Heck Cyclization of Equilibrating Enamines
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A Short Synthesis of (±)‐3‐Demethoxyerythratidinone by Ligand‐Controlled Selective Heck Cyclization of Equilibrating Enamines

Blackham, Emma E. ; Booker‐Milburn, Kevin I.

Angewandte Chemie, 2017-06, Vol.129 (23), p.6713-6716 [Periódico revisado por pares]

Weinheim: Wiley Subscription Services, Inc

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5
Organocatalytic Enantioselective Protonation for Photoreduction of Activated Ketones and Ketimines Induced by Visible Light
Organocatalytic Enantioselective Protonation for Photoreduction of Activated Ketones and Ketimines Induced by Visible Light
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Organocatalytic Enantioselective Protonation for Photoreduction of Activated Ketones and Ketimines Induced by Visible Light

Lin, Lu ; Bai, Xiangbin ; Ye, Xinyi ; Zhao, Xiaowei ; Tan, Choon‐Hong ; Jiang, Zhiyong

Angewandte Chemie, 2017-10, Vol.129 (44), p.14030-14034 [Periódico revisado por pares]

Weinheim: Wiley Subscription Services, Inc

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6
The Dewar Isomer of 1,2‐Dihydro‐1,2‐azaborinines: Isolation, Fragmentation, and Energy Storage
The Dewar Isomer of 1,2‐Dihydro‐1,2‐azaborinines: Isolation, Fragmentation, and Energy Storage
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The Dewar Isomer of 1,2‐Dihydro‐1,2‐azaborinines: Isolation, Fragmentation, and Energy Storage

Edel, Klara ; Yang, Xinyu ; Ishibashi, Jacob S. A. ; Lamm, Ashley N. ; Maichle‐Mössmer, Cäcilia ; Giustra, Zachary X. ; Liu, Shih‐Yuan ; Bettinger, Holger F.

Angewandte Chemie, 2018-05, Vol.130 (19), p.5394-5398 [Periódico revisado por pares]

Weinheim: Wiley Subscription Services, Inc

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7
Model Systems for Activation of Nucleic Acid Encoded Prodrugs
Model Systems for Activation of Nucleic Acid Encoded Prodrugs
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Model Systems for Activation of Nucleic Acid Encoded Prodrugs

Jacobsen, Mikkel F. ; Cló, Emiliano ; Mokhir, Andriy ; Gothelf, Kurt V.

ChemMedChem, 2007-06, Vol.2 (6), p.793-799 [Periódico revisado por pares]

Weinheim: WILEY-VCH Verlag

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8
Methods for describing open-shell systems: Following the trail of Rosa Caballol's research
Methods for describing open-shell systems: Following the trail of Rosa Caballol's research
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Methods for describing open-shell systems: Following the trail of Rosa Caballol's research

de Graaf, Coen ; Reguero, Mar

International journal of quantum chemistry, 2014-04, Vol.114 (8), p.481-492 [Periódico revisado por pares]

Hoboken: Blackwell Publishing Ltd

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9
[2+2] Photocycloaddition of Cinnamates in Flow and Development of a Thiourea Catalyst
[2+2] Photocycloaddition of Cinnamates in Flow and Development of a Thiourea Catalyst
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[2+2] Photocycloaddition of Cinnamates in Flow and Development of a Thiourea Catalyst

Telmesani, Reem ; Park, Sung H. ; Lynch-Colameta, Tessa ; Beeler, Aaron B.

Angewandte Chemie, 2015-09, Vol.127 (39), p.11683-11687 [Periódico revisado por pares]

Weinheim: WILEY-VCH Verlag

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10
Quantum Mechanics/Molecular Mechanics Study on the Photoreactions of Dark‐ and Light‐Adapted States of a Blue‐Light YtvA LOV Photoreceptor
Quantum Mechanics/Molecular Mechanics Study on the Photoreactions of Dark‐ and Light‐Adapted States of a Blue‐Light YtvA LOV Photoreceptor
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Quantum Mechanics/Molecular Mechanics Study on the Photoreactions of Dark‐ and Light‐Adapted States of a Blue‐Light YtvA LOV Photoreceptor

Chang, Xue‐Ping ; Gao, Yuan‐Jun ; Fang, Wei‐Hai ; Cui, Ganglong ; Thiel, Walter

Angewandte Chemie, 2017-08, Vol.129 (32), p.9469-9473 [Periódico revisado por pares]

Weinheim: Wiley Subscription Services, Inc

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