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1 |
Material Type: Artigo
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Single vacancy-defect endohedral metallofullerene-superhalogens: molecular topology and nonlinear optical responses of Na@C59[9-4]([8-5])-AlX4 (X = Cl, Br) systemsOmri, Nabil ; Besbes, Néji ; Bu, YuxiangNew journal of chemistry, 2023-11, Vol.47 (46), p.21332-21343 [Periódico revisado por pares]Cambridge: Royal Society of ChemistryTexto completo disponível |
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Material Type: Artigo
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Tandem Mass Spectrometric Characterization of Thiol Peptides Modified by the Chemoselective Cationic Sulfhydryl Reagent (4-Iodobutyl)Triphenylphosphonium: Effects of a Cationic Thiol Derivatization on Peptide FragmentationWang, Jing ; Zhang, Jie ; Arbogast, Brian ; Maier, Claudia S.Journal of the American Society for Mass Spectrometry, 2011-10, Vol.22 (10), p.1771-1783 [Periódico revisado por pares]New York: Springer-VerlagTexto completo disponível |
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3 |
Material Type: Artigo
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Theoretical Studies on Two-Dimensional Nonlinear Optical Chromophores with Pyrazinyl Cores and Organic or Ruthenium(II) Ammine Electron DonorsCoe, Benjamin J ; Pilkington, Rachel AThe journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2014-03, Vol.118 (12), p.2253-2268 [Periódico revisado por pares]United States: American Chemical SocietyTexto completo disponível |
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4 |
Material Type: Artigo
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Enzymatic Fragment Condensation of Side Chain-Protected Peptides using Subtilisin A in Anhydrous Organic Solvents: A General Strategy for Industrial Peptide SynthesisNuijens, Timo ; Schepers, Annette H. M. ; Cusan, Claudia ; Kruijtzer, John A. W. ; Rijkers, Dirk T. S. ; Liskamp, Rob M. J. ; Quaedflieg, Peter J. L. M.Advanced synthesis & catalysis, 2013-02, Vol.355 (2-3), p.287-293 [Periódico revisado por pares]Weinheim: WILEY-VCH VerlagTexto completo disponível |
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5 |
Material Type: Artigo
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Experimental and theoretical DFT (B3LYP, X3LYP, CAM-B3LYP and M06-2X) study on electronic structure, spectral features, hydrogen bonding and solvent effects of 4-methylthiadiazole-5-carboxylic acidSingh, Isha ; El-Emam, Ali A. ; Pathak, Shilendra K. ; Srivastava, Ruchi ; Shukla, Vikas K. ; Prasad, Onkar ; Sinha, LeenaMolecular simulation, 2019-09, Vol.45 (13), p.1029-1043 [Periódico revisado por pares]Abingdon: Taylor & FrancisTexto completo disponível |
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6 |
Material Type: Artigo
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Tandem Mass Spectrometric Characterization of Thiol Peptides Modified by the Chemoselective Cationic Sulfhydryl Reagent (4-lodobutyl) TriphenylphosphoniumJING WANG ; JIE ZHANG ; ARBOGAST, Brian ; MAIER, Claudia SJournal of the American Society for Mass Spectrometry, 2011-10, Vol.22 (10), p.1771-1783, Article s13361-011-0192-y [Periódico revisado por pares]Amsterdam: ElsevierTexto completo disponível |
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7 |
Material Type: Artigo
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Synthesis, DFT calculations, α‐glucosidase inhibitor activity, and docking studies on Schiff base metal complexes containing isothiocyanateÖzge, Özgen ; Avcı, Davut ; Sönmez, Fatih ; Tamer, Ömer ; Dege, Necmi ; Başoğlu, Adil ; Atalay, Yusuf ; Kurt, Belma ZenginApplied organometallic chemistry, 2023-05, Vol.37 (5), p.n/a [Periódico revisado por pares]Chichester: Wiley Subscription Services, IncTexto completo disponível |
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8 |
Material Type: Artigo
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Easy to Use DFT Approach for Computational pKa Determination of Carboxylic AcidsPezzola, Silvia ; Venanzi, Mariano ; Galloni, Pierluca ; Conte, Valeria ; Sabuzi, FedericaChemistry : a European journal, 2024-01, Vol.30 (1), p.e202303167-n/a [Periódico revisado por pares]Germany: Wiley Subscription Services, IncTexto completo disponível |
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9 |
Material Type: Artigo
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Acceptor tuning effect on TPA-based organic efficient sensitizers for optoelectronic applications—quantum chemical investigationArunkumar, Ammasi ; Shanavas, Shajahan ; Acevedo, Roberto ; Anbarasan, Ponnusamy MunusamyStructural chemistry, 2020-06, Vol.31 (3), p.1029-1042 [Periódico revisado por pares]New York: Springer USTexto completo disponível |
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10 |
Material Type: Artigo
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Carbazole-Based Mono and Bis-styryl NLOphores: Structure Property CorrelationsRajeshirke, Manali ; Katariya, Santosh B. ; Sekar, NagaiyanJournal of solution chemistry, 2017-11, Vol.46 (11), p.2109-2129 [Periódico revisado por pares]New York: Springer USTexto completo disponível |