Evidence for sevenfold coordination in the first solvation shell of Hg (II) aqua ion G Chillemi, G Mancini, N Sanna, V Barone, S Della Longa, M Benfatto, ... Journal of the American Chemical Society 129 (17), 5430-5436, 2007 | 99 | 2007 |
Identification of a short region on chromosome 6 affecting direct calving ease in Piedmontese cattle breed S Bongiorni, G Mancini, G Chillemi, L Pariset, A Valentini PLoS One 7 (12), e50137, 2012 | 75 | 2012 |
Experimental Evidence for a Variable First Coordination Shell of the Cadmium(II) Ion in Aqueous, Dimethyl Sulfoxide, and N,N‘-Dimethylpropyleneurea Solution P D'Angelo, G Chillemi, V Barone, G Mancini, N Sanna, I Persson The Journal of Physical Chemistry B 109 (18), 9178-9185, 2005 | 71 | 2005 |
XANES reveals the flexible nature of hydrated strontium in aqueous solution P D’Angelo, V Migliorati, F Sessa, G Mancini, I Persson The Journal of Physical Chemistry B 120 (17), 4114-4124, 2016 | 67 | 2016 |
Computational evidence for a variable first shell coordination of the cadmium (II) ion in aqueous solution G Chillemi, V Barone, P D'Angelo, G Mancini, I Persson, N Sanna The Journal of Physical Chemistry B 109 (18), 9186-9193, 2005 | 66 | 2005 |
Immersive virtual reality in computational chemistry: Applications to the analysis of QM and MM data A Salvadori, G Del Frate, M Pagliai, G Mancini, V Barone International journal of quantum chemistry 116 (22), 1731-1746, 2016 | 61 | 2016 |
A coupled molecular dynamics and XANES data analysis investigation of aqueous cadmium (II) P D’Angelo, V Migliorati, G Mancini, G Chillemi The Journal of Physical Chemistry A 112 (46), 11833-11841, 2008 | 61 | 2008 |
An X-ray diffraction and X-ray absorption spectroscopy joint study of neuroglobin A Arcovito, T Moschetti, P D’Angelo, G Mancini, B Vallone, M Brunori, ... Archives of biochemistry and biophysics 475 (1), 7-13, 2008 | 61 | 2008 |
Structural investigation of lanthanoid coordination: a combined XANES and molecular dynamics study P D’Angelo, A Zitolo, V Migliorati, G Mancini, I Persson, G Chillemi Inorganic chemistry 48 (21), 10239-10248, 2009 | 60 | 2009 |
Structural and Dynamical Properties of the Hg2+ Aqua Ion: A Molecular Dynamics Study G Mancini, N Sanna, V Barone, V Migliorati, P D'Angelo, G Chillemi The Journal of Physical Chemistry B 112 (15), 4694-4702, 2008 | 59 | 2008 |
Integrated experimental and theoretical approach for the structural characterization of Hg2+ aqueous solutions P D’Angelo, V Migliorati, G Mancini, V Barone, G Chillemi The Journal of chemical physics 128 (8), 2008 | 57 | 2008 |
Force field parametrization of metal ions from statistical learning techniques F Fracchia, G Del Frate, G Mancini, W Rocchia, V Barone Journal of chemical theory and computation 14 (1), 255-273, 2018 | 56 | 2018 |
Hydration Properties of the Zn2+ Ion in Water at High Pressure V Migliorati, G Mancini, S Tatoli, A Zitolo, A Filipponi, S De Panfilis, ... Inorganic chemistry 52 (2), 1141-1150, 2013 | 56 | 2013 |
Genome assembly and transcriptome resource for river buffalo, Bubalus bubalis (2n = 50) JL Williams, D Iamartino, KD Pruitt, T Sonstegard, TPL Smith, WY Low, ... Gigascience 6 (10), gix088, 2017 | 51 | 2017 |
Structural and dynamical effects induced by the anticancer drug topotecan on the human topoisomerase I–DNA complex G Mancini, I D'Annessa, A Coletta, N Sanna, G Chillemi, A Desideri PloS one 5 (6), e10934, 2010 | 49 | 2010 |
Relative extended haplotype homozygosity signals across breeds reveal dairy and beef specific signatures of selection L Bomba, EL Nicolazzi, M Milanesi, R Negrini, G Mancini, F Biscarini, ... Genetics Selection Evolution 47, 1-14, 2015 | 48 | 2015 |
On the coordination of Zn 2+ ion in Tf 2 N− based ionic liquids: structural and dynamic properties depending on the nature of the organic cation F Sessa, V Migliorati, A Serva, A Lapi, G Aquilanti, G Mancini, P D'Angelo Physical Chemistry Chemical Physics 20 (4), 2662-2675, 2018 | 47 | 2018 |
The non-octarepeat copper binding site of the prion protein is a key regulator of prion conversion G Giachin, PT Mai, TH Tran, G Salzano, F Benetti, V Migliorati, A Arcovito, ... Scientific reports 5 (1), 15253, 2015 | 46 | 2015 |
UV− Vis Spectra of the Anticancer Campothecin Family Drugs in Aqueous Solution: Specific Spectroscopic Signatures Unraveled by a Combined Computational and Experimental Study N Sanna, G Chillemi, L Gontrani, A Grandi, G Mancini, S Castelli, ... The Journal of Physical Chemistry B 113 (16), 5369-5375, 2009 | 46 | 2009 |
Insights into structural and dynamical features of water at halloysite interfaces probed by DFT and classical molecular dynamics simulations D Presti, A Pedone, G Mancini, C Duce, MR Tiné, V Barone Physical Chemistry Chemical Physics 18 (3), 2164-2174, 2016 | 44 | 2016 |