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Chlorine Incorporation in the CH.

Inorganic chemistry

Quarti C, Mosconi E, Umari P, De Angelis F.
PMID: 27668448
Inorg Chem. 2017 Jan 03;56(1):74-83. doi: 10.1021/acs.inorgchem.6b01681. Epub 2016 Sep 26.

The role of chlorine doping in CH

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Quarti C, Mosconi E, Umari P, et al. Chlorine Incorporation in the CH. Inorg Chem. 2016;56(1):74-83doi: 10.1021/acs.inorgchem.6b01681.
Quarti, C., Mosconi, E., Umari, P., & De Angelis, F. (2017). Chlorine Incorporation in the CH. Inorganic chemistry, 56(1), 74-83. https://doi.org/10.1021/acs.inorgchem.6b01681
Quarti, Claudio, et al. "Chlorine Incorporation in the CH." Inorganic chemistry vol. 56,1 (2017): 74-83. doi: https://doi.org/10.1021/acs.inorgchem.6b01681
Quarti C, Mosconi E, Umari P, De Angelis F. Chlorine Incorporation in the CH. Inorg Chem. 2017 Jan 03;56(1):74-83. doi: 10.1021/acs.inorgchem.6b01681. Epub 2016 Sep 26. PMID: 27668448.
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Structural and photophysical properties of rare-earth complexes encapsulated into surface modified mesoporous silica nanoparticles.

Dalton transactions (Cambridge, England : 2003)

Malba C, Sudhakaran UP, Borsacchi S, Geppi M, Enrichi F, Natile MM, Armelao L, Finotto T, Marin R, Riello P, Benedetti A.
PMID: 24874265
Dalton Trans. 2014 Nov 21;43(43):16183-96. doi: 10.1039/c4dt00760c.

The encapsulation of [Eu(dbm)3phen] into functionalized mesoporous silica nanoparticles (MSN) has been carried out to study the effect of chemical environments on the photoluminescence properties of the rare-earth complex. Surface functionalization was achieved by the reaction of the silanol...

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Malba C, Sudhakaran UP, Borsacchi S, et al. Structural and photophysical properties of rare-earth complexes encapsulated into surface modified mesoporous silica nanoparticles. Dalton Trans. 2014;43(43):16183-96doi: 10.1039/c4dt00760c.
Malba, C., Sudhakaran, U. P., Borsacchi, S., Geppi, M., Enrichi, F., Natile, M. M., Armelao, L., Finotto, T., Marin, R., Riello, P., & Benedetti, A. (2014). Structural and photophysical properties of rare-earth complexes encapsulated into surface modified mesoporous silica nanoparticles. Dalton transactions (Cambridge, England : 2003), 43(43), 16183-96. https://doi.org/10.1039/c4dt00760c
Malba, Chandrashekhar, et al. "Structural and photophysical properties of rare-earth complexes encapsulated into surface modified mesoporous silica nanoparticles." Dalton transactions (Cambridge, England : 2003) vol. 43,43 (2014): 16183-96. doi: https://doi.org/10.1039/c4dt00760c
Malba C, Sudhakaran UP, Borsacchi S, Geppi M, Enrichi F, Natile MM, Armelao L, Finotto T, Marin R, Riello P, Benedetti A. Structural and photophysical properties of rare-earth complexes encapsulated into surface modified mesoporous silica nanoparticles. Dalton Trans. 2014 Nov 21;43(43):16183-96. doi: 10.1039/c4dt00760c. PMID: 24874265.
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Electronic and optical properties of MAPbX.

Physical chemistry chemical physics : PCCP

Mosconi E, Umari P, De Angelis F.
PMID: 27711483
Phys Chem Chem Phys. 2016 Oct 05;18(39):27158-27164. doi: 10.1039/c6cp03969c.

Materials engineering is a key for the enhancement of photovoltaics technology. This is particularly true for the novel class of perovskite solar cells. Accurate theoretical modelling can help establish general trends of behavior when addressing structural changes. Here, we...

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Mosconi E, Umari P, De Angelis F. Electronic and optical properties of MAPbX. Phys Chem Chem Phys. 2016;18(39):27158-27164doi: 10.1039/c6cp03969c.
Mosconi, E., Umari, P., & De Angelis, F. (2016). Electronic and optical properties of MAPbX. Physical chemistry chemical physics : PCCP, 18(39), 27158-27164. https://doi.org/10.1039/c6cp03969c
Mosconi, Edoardo, et al. "Electronic and optical properties of MAPbX." Physical chemistry chemical physics : PCCP vol. 18,39 (2016): 27158-27164. doi: https://doi.org/10.1039/c6cp03969c
Mosconi E, Umari P, De Angelis F. Electronic and optical properties of MAPbX. Phys Chem Chem Phys. 2016 Oct 05;18(39):27158-27164. doi: 10.1039/c6cp03969c. PMID: 27711483.
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Cergutuzumab amunaleukin (CEA-IL2v), a CEA-targeted IL-2 variant-based immunocytokine for combination cancer immunotherapy: Overcoming limitations of aldesleukin and conventional IL-2-based immunocytokines.

Oncoimmunology

Klein C, Waldhauer I, Nicolini VG, Freimoser-Grundschober A, Nayak T, Vugts DJ, Dunn C, Bolijn M, Benz J, Stihle M, Lang S, Roemmele M, Hofer T, van Puijenbroek E, Wittig D, Moser S, Ast O, Brünker P, Gorr IH, Neumann S, de Vera Mudry MC, Hinton H, Crameri F, Saro J, Evers S, Gerdes C, Bacac M, van Dongen G, Moessner E, Umaña P.
PMID: 28405498
Oncoimmunology. 2017 Jan 11;6(3):e1277306. doi: 10.1080/2162402X.2016.1277306. eCollection 2017.

We developed cergutuzumab amunaleukin (CEA-IL2v, RG7813), a novel monomeric CEA-targeted immunocytokine, that comprises a single IL-2 variant (IL2v) moiety with abolished CD25 binding, fused to the C-terminus of a high affinity, bivalent carcinoembryonic antigen (CEA)-specific antibody devoid of Fc-mediated...

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Klein C, Waldhauer I, Nicolini VG, et al. Cergutuzumab amunaleukin (CEA-IL2v), a CEA-targeted IL-2 variant-based immunocytokine for combination cancer immunotherapy: Overcoming limitations of aldesleukin and conventional IL-2-based immunocytokines. Oncoimmunology. 2017;6(3):e1277306doi: 10.1080/2162402X.2016.1277306.
Klein, C., Waldhauer, I., Nicolini, V. G., Freimoser-Grundschober, A., Nayak, T., Vugts, D. J., Dunn, C., Bolijn, M., Benz, J., Stihle, M., Lang, S., Roemmele, M., Hofer, T., van Puijenbroek, E., Wittig, D., Moser, S., Ast, O., Brünker, P., Gorr, I. H., Neumann, S., de Vera Mudry, M. C., Hinton, H., Crameri, F., Saro, J., Evers, S., Gerdes, C., Bacac, M., van Dongen, G., Moessner, E., & Umaña, P. (2017). Cergutuzumab amunaleukin (CEA-IL2v), a CEA-targeted IL-2 variant-based immunocytokine for combination cancer immunotherapy: Overcoming limitations of aldesleukin and conventional IL-2-based immunocytokines. Oncoimmunology, 6(3), e1277306. https://doi.org/10.1080/2162402X.2016.1277306
Klein, Christian, et al. "Cergutuzumab amunaleukin (CEA-IL2v), a CEA-targeted IL-2 variant-based immunocytokine for combination cancer immunotherapy: Overcoming limitations of aldesleukin and conventional IL-2-based immunocytokines." Oncoimmunology vol. 6,3 (2017): e1277306. doi: https://doi.org/10.1080/2162402X.2016.1277306
Klein C, Waldhauer I, Nicolini VG, Freimoser-Grundschober A, Nayak T, Vugts DJ, Dunn C, Bolijn M, Benz J, Stihle M, Lang S, Roemmele M, Hofer T, van Puijenbroek E, Wittig D, Moser S, Ast O, Brünker P, Gorr IH, Neumann S, de Vera Mudry MC, Hinton H, Crameri F, Saro J, Evers S, Gerdes C, Bacac M, van Dongen G, Moessner E, Umaña P. Cergutuzumab amunaleukin (CEA-IL2v), a CEA-targeted IL-2 variant-based immunocytokine for combination cancer immunotherapy: Overcoming limitations of aldesleukin and conventional IL-2-based immunocytokines. Oncoimmunology. 2017 Jan 11;6(3):e1277306. doi: 10.1080/2162402X.2016.1277306. eCollection 2017. PMID: 28405498; PMCID: PMC5384349.
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Complex spatio-temporal features in meg data.

Mathematical biosciences and engineering : MBE

Sapuppo F, Umana E, Frasca M, Rosa ML, Shannahoff-Khalsa D, Fortuna L, Bucolo M.
PMID: 20361840
Math Biosci Eng. 2006 Oct;3(4):697-716. doi: 10.3934/mbe.2006.3.697.

Magnetoencephalography (MEG) brain signals are studied using a method for characterizing complex nonlinear dynamics. This approach uses the value of d(infinity) (d-infinite) to characterize the system's asymptotic chaotic behavior. A novel procedure has been developed to extract this parameter...

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Sapuppo F, Umana E, Frasca M, et al. Complex spatio-temporal features in meg data. Math Biosci Eng. 2006;3(4):697-716doi: 10.3934/mbe.2006.3.697.
Sapuppo, F., Umana, E., Frasca, M., Rosa, M. L., Shannahoff-Khalsa, D., Fortuna, L., & Bucolo, M. (2006). Complex spatio-temporal features in meg data. Mathematical biosciences and engineering : MBE, 3(4), 697-716. https://doi.org/10.3934/mbe.2006.3.697
Sapuppo, Francesca, et al. "Complex spatio-temporal features in meg data." Mathematical biosciences and engineering : MBE vol. 3,4 (2006): 697-716. doi: https://doi.org/10.3934/mbe.2006.3.697
Sapuppo F, Umana E, Frasca M, Rosa ML, Shannahoff-Khalsa D, Fortuna L, Bucolo M. Complex spatio-temporal features in meg data. Math Biosci Eng. 2006 Oct;3(4):697-716. doi: 10.3934/mbe.2006.3.697. PMID: 20361840.
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Valence electronic properties of porphyrin derivatives.

Physical chemistry chemical physics : PCCP

Stenuit G, Castellarin-Cudia C, Plekan O, Feyer V, Prince KC, Goldoni A, Umari P.
PMID: 20661502
Phys Chem Chem Phys. 2010 Sep 28;12(36):10812-7. doi: 10.1039/c004332j. Epub 2010 Jul 27.

We present a combined experimental and theoretical investigation of the valence electronic structure of porphyrin-derived molecules. The valence photoemission spectra of the free-base tetraphenylporphyrin and of the octaethylporphyrin molecule were measured using synchrotron radiation and compared with theoretical spectra...

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Stenuit G, Castellarin-Cudia C, Plekan O, et al. Valence electronic properties of porphyrin derivatives. Phys Chem Chem Phys. 2010;12(36):10812-7doi: 10.1039/c004332j.
Stenuit, G., Castellarin-Cudia, C., Plekan, O., Feyer, V., Prince, K. C., Goldoni, A., & Umari, P. (2010). Valence electronic properties of porphyrin derivatives. Physical chemistry chemical physics : PCCP, 12(36), 10812-7. https://doi.org/10.1039/c004332j
Stenuit, G, et al. "Valence electronic properties of porphyrin derivatives." Physical chemistry chemical physics : PCCP vol. 12,36 (2010): 10812-7. doi: https://doi.org/10.1039/c004332j
Stenuit G, Castellarin-Cudia C, Plekan O, Feyer V, Prince KC, Goldoni A, Umari P. Valence electronic properties of porphyrin derivatives. Phys Chem Chem Phys. 2010 Sep 28;12(36):10812-7. doi: 10.1039/c004332j. Epub 2010 Jul 27. PMID: 20661502.
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Importance of semicore states in GW calculations for simulating accurately the photoemission spectra of metal phthalocyanine molecules.

The Journal of chemical physics

Umari P, Fabris S.
PMID: 22583233
J Chem Phys. 2012 May 07;136(17):174310. doi: 10.1063/1.4705360.

The quasi-particle energy levels of the Zn-Phthalocyanine (ZnPc) molecule calculated with the GW approximation are shown to depend sensitively on the explicit description of the metal-center semicore states. We find that the calculated GW energy levels are in good...

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Umari P, Fabris S. Importance of semicore states in GW calculations for simulating accurately the photoemission spectra of metal phthalocyanine molecules. J Chem Phys. 2012;136(17):174310doi: 10.1063/1.4705360.
Umari, P., & Fabris, S. (2012). Importance of semicore states in GW calculations for simulating accurately the photoemission spectra of metal phthalocyanine molecules. The Journal of chemical physics, 136(17), 174310. https://doi.org/10.1063/1.4705360
Umari, P, and Fabris, S. "Importance of semicore states in GW calculations for simulating accurately the photoemission spectra of metal phthalocyanine molecules." The Journal of chemical physics vol. 136,17 (2012): 174310. doi: https://doi.org/10.1063/1.4705360
Umari P, Fabris S. Importance of semicore states in GW calculations for simulating accurately the photoemission spectra of metal phthalocyanine molecules. J Chem Phys. 2012 May 07;136(17):174310. doi: 10.1063/1.4705360. PMID: 22583233.
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QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials.

Journal of physics. Condensed matter : an Institute of Physics journal

Giannozzi P, Baroni S, Bonini N, Calandra M, Car R, Cavazzoni C, Ceresoli D, Chiarotti GL, Cococcioni M, Dabo I, Dal Corso A, de Gironcoli S, Fabris S, Fratesi G, Gebauer R, Gerstmann U, Gougoussis C, Kokalj A, Lazzeri M, Martin-Samos L, Marzari N, Mauri F, Mazzarello R, Paolini S, Pasquarello A, Paulatto L, Sbraccia C, Scandolo S, Sclauzero G, Seitsonen AP, Smogunov A, Umari P, Wentzcovitch RM.
PMID: 21832390
J Phys Condens Matter. 2009 Sep 30;21(39):395502. doi: 10.1088/0953-8984/21/39/395502. Epub 2009 Sep 01.

QUANTUM ESPRESSO is an integrated suite of computer codes for electronic-structure calculations and materials modeling, based on density-functional theory, plane waves, and pseudopotentials (norm-conserving, ultrasoft, and projector-augmented wave). The acronym ESPRESSO stands for opEn Source Package for Research in...

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Giannozzi P, Baroni S, Bonini N, et al. QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials. J Phys Condens Matter. 2009;21(39):395502doi: 10.1088/0953-8984/21/39/395502.
Giannozzi, P., Baroni, S., Bonini, N., Calandra, M., Car, R., Cavazzoni, C., Ceresoli, D., Chiarotti, G. L., Cococcioni, M., Dabo, I., Dal Corso, A., de Gironcoli, S., Fabris, S., Fratesi, G., Gebauer, R., Gerstmann, U., Gougoussis, C., Kokalj, A., Lazzeri, M., Martin-Samos, L., Marzari, N., Mauri, F., Mazzarello, R., Paolini, S., Pasquarello, A., Paulatto, L., Sbraccia, C., Scandolo, S., Sclauzero, G., Seitsonen, A. P., Smogunov, A., Umari, P., & Wentzcovitch, R. M. (2009). QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials. Journal of physics. Condensed matter : an Institute of Physics journal, 21(39), 395502. https://doi.org/10.1088/0953-8984/21/39/395502
Giannozzi, Paolo, et al. "QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials." Journal of physics. Condensed matter : an Institute of Physics journal vol. 21,39 (2009): 395502. doi: https://doi.org/10.1088/0953-8984/21/39/395502
Giannozzi P, Baroni S, Bonini N, Calandra M, Car R, Cavazzoni C, Ceresoli D, Chiarotti GL, Cococcioni M, Dabo I, Dal Corso A, de Gironcoli S, Fabris S, Fratesi G, Gebauer R, Gerstmann U, Gougoussis C, Kokalj A, Lazzeri M, Martin-Samos L, Marzari N, Mauri F, Mazzarello R, Paolini S, Pasquarello A, Paulatto L, Sbraccia C, Scandolo S, Sclauzero G, Seitsonen AP, Smogunov A, Umari P, Wentzcovitch RM. QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials. J Phys Condens Matter. 2009 Sep 30;21(39):395502. doi: 10.1088/0953-8984/21/39/395502. Epub 2009 Sep 01. PMID: 21832390.
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Energy minimization using the classical density distribution: Application to sodium chloride clusters.

Physical review. B, Condensed matter

Amara P, Straub JE.
PMID: 9983141
Phys Rev B Condens Matter. 1996 May 15;53(20):13857-13863. doi: 10.1103/physrevb.53.13857.

No abstract available.

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Amara P, Straub JE. Energy minimization using the classical density distribution: Application to sodium chloride clusters. Phys Rev B Condens Matter. 1996;53(20):13857-13863doi: 10.1103/physrevb.53.13857.
Amara, P., & Straub, J. E. (1996). Energy minimization using the classical density distribution: Application to sodium chloride clusters. Physical review. B, Condensed matter, 53(20), 13857-13863. https://doi.org/10.1103/physrevb.53.13857
Amara, and Straub. "Energy minimization using the classical density distribution: Application to sodium chloride clusters." Physical review. B, Condensed matter vol. 53,20 (1996): 13857-13863. doi: https://doi.org/10.1103/physrevb.53.13857
Amara P, Straub JE. Energy minimization using the classical density distribution: Application to sodium chloride clusters. Phys Rev B Condens Matter. 1996 May 15;53(20):13857-13863. doi: 10.1103/physrevb.53.13857. PMID: 9983141.
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Epidemiology and Characteristics of Cervical Spine Injury in Patients Presenting to a Regional Emergency Department.

Cureus

Umana E, Khan K, Baig MN, Binchy J.
PMID: 29651372
Cureus. 2018 Feb 10;10(2):e2179. doi: 10.7759/cureus.2179.

Purpose This study aims to establish the demographics and characteristics of patients with cervical spine injury (CSI) in an Irish cohort presenting to a regional emergency department. Methods We performed a retrospective analysis of the medical records of patients...

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Umana E, Khan K, Baig MN, et al. Epidemiology and Characteristics of Cervical Spine Injury in Patients Presenting to a Regional Emergency Department. Cureus. 2018;10(2):e2179doi: 10.7759/cureus.2179.
Umana, E., Khan, K., Baig, M. N., & Binchy, J. (2018). Epidemiology and Characteristics of Cervical Spine Injury in Patients Presenting to a Regional Emergency Department. Cureus, 10(2), e2179. https://doi.org/10.7759/cureus.2179
Umana, Etimbuk, et al. "Epidemiology and Characteristics of Cervical Spine Injury in Patients Presenting to a Regional Emergency Department." Cureus vol. 10,2 (2018): e2179. doi: https://doi.org/10.7759/cureus.2179
Umana E, Khan K, Baig MN, Binchy J. Epidemiology and Characteristics of Cervical Spine Injury in Patients Presenting to a Regional Emergency Department. Cureus. 2018 Feb 10;10(2):e2179. doi: 10.7759/cureus.2179. PMID: 29651372; PMCID: PMC5893180.
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Patients with aortic stenosis referred for TAVI: treatment decision, in-hospital outcome and determinants of survival.

Netherlands heart journal : monthly journal of the Netherlands Society of Cardiology and the Netherlands Heart Foundation

Nuis RJ, Dager AE, van der Boon RM, Jaimes MC, Caicedo B, Fonseca J, Van Mieghem NM, Benitez LM, Umana JP, O'Neill WW, de Marchena E, de Jaegere PP.
PMID: 22167520
Neth Heart J. 2012 Jan;20(1):16-23. doi: 10.1007/s12471-011-0224-z.

AIMS: To assess treatment decision and outcome in patients referred for transcatheter aortic valve implantation (TAVI) in addition to predictive factors of mortality after TAVI.METHODS: Three-centre prospective observational study including 358 patients. Endpoints were defined according to the Valve...

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Nuis RJ, Dager AE, van der Boon RM, et al. Patients with aortic stenosis referred for TAVI: treatment decision, in-hospital outcome and determinants of survival. Neth Heart J. 2012;20(1):16-23doi: 10.1007/s12471-011-0224-z.
Nuis, R. J., Dager, A. E., van der Boon, R. M., Jaimes, M. C., Caicedo, B., Fonseca, J., Van Mieghem, N. M., Benitez, L. M., Umana, J. P., O'Neill, W. W., de Marchena, E., & de Jaegere, P. P. (2012). Patients with aortic stenosis referred for TAVI: treatment decision, in-hospital outcome and determinants of survival. Netherlands heart journal : monthly journal of the Netherlands Society of Cardiology and the Netherlands Heart Foundation, 20(1), 16-23. https://doi.org/10.1007/s12471-011-0224-z
Nuis, R J, et al. "Patients with aortic stenosis referred for TAVI: treatment decision, in-hospital outcome and determinants of survival." Netherlands heart journal : monthly journal of the Netherlands Society of Cardiology and the Netherlands Heart Foundation vol. 20,1 (2012): 16-23. doi: https://doi.org/10.1007/s12471-011-0224-z
Nuis RJ, Dager AE, van der Boon RM, Jaimes MC, Caicedo B, Fonseca J, Van Mieghem NM, Benitez LM, Umana JP, O'Neill WW, de Marchena E, de Jaegere PP. Patients with aortic stenosis referred for TAVI: treatment decision, in-hospital outcome and determinants of survival. Neth Heart J. 2012 Jan;20(1):16-23. doi: 10.1007/s12471-011-0224-z. PMID: 22167520; PMCID: PMC3247629.
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Effects of Reflective Labyrinth Walking Assessed Using a Questionnaire.

Medicines (Basel, Switzerland)

Lizier DS, Silva-Filho R, Umada J, Melo R, Neves AC.
PMID: 30336569
Medicines (Basel). 2018 Oct 17;5(4). doi: 10.3390/medicines5040111.

No abstract available.

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Lizier DS, Silva-Filho R, Umada J, et al. Effects of Reflective Labyrinth Walking Assessed Using a Questionnaire. Medicines (Basel). 2018;5(4)doi: 10.3390/medicines5040111.
Lizier, D. S., Silva-Filho, R., Umada, J., Melo, R., & Neves, A. C. (2018). Effects of Reflective Labyrinth Walking Assessed Using a Questionnaire. Medicines (Basel, Switzerland), 5(4), . https://doi.org/10.3390/medicines5040111
Lizier, Daniele S, et al. "Effects of Reflective Labyrinth Walking Assessed Using a Questionnaire." Medicines (Basel, Switzerland) vol. 5,4 (2018). doi: https://doi.org/10.3390/medicines5040111
Lizier DS, Silva-Filho R, Umada J, Melo R, Neves AC. Effects of Reflective Labyrinth Walking Assessed Using a Questionnaire. Medicines (Basel). 2018 Oct 17;5(4). doi: 10.3390/medicines5040111. PMID: 30336569; PMCID: PMC6313772.
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