Kasper P. Kepp

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Ulf RydeProfessor in Theoretical Chemistry, Lund UniversityVerificeret mail på teokem.lu.se
Rukmankesh MehraIIT BhilaiVerificeret mail på iitbhilai.ac.in
Arun Kumar SomavarapuUmass Chan Medical School, USAVerificeret mail på umassmed.edu
Pouria DasmehScientist and Group Leader @ Institute for Human Genetics, UKGM medical center, Marburg UniversityVerificeret mail på staff.uni-marburg.de
Dr. Budheswar DehuryAssistant Professor, BioinformaticsVerificeret mail på manipal.edu
Klaus August MoltvedTechnical University of DenmarkVerificeret mail på kemi.dtu.dk
Tom L BlundellEmeritus Professor of Biochemistry, University of CambridgeVerificeret mail på cam.ac.uk
Manish K. TiwariNovozymesVerificeret mail på novozymes.com
William L. JorgensenSterling Professor of Chemistry, Yale UniversityVerificeret mail på yale.edu
Poul Flemming Høilund-Carlsenprofessor i klnisk fysiologi, Syddansk Universitet, Odense, DanmarkVerificeret mail på rsyd.dk
Anne S Meyer, ProfessorTechnical University of DenmarkVerificeret mail på dtu.dk
Louise EmilssonHarvard School of Public HealthVerificeret mail på hsph.harvard.edu
N RobakisProfessor, Mount Sinai School of MedicineVerificeret mail på mssm.edu
Kristoffer T. BækDTU - Technical University of DenmarkVerificeret mail på sund.ku.dk
Octav CaldararuZealand PharmaVerificeret mail på zealandpharma.com
Carsten JersDTU BiosustainVerificeret mail på biosustain.dtu.dk
Adrian SerohijosUniversity of MontrealVerificeret mail på umontreal.ca
Eugene ShakhnovichProfessor of Chemistry Harvard UniversityVerificeret mail på chemistry.harvard.edu
jorge barrioThe David Geffen UCLA School of MedicineVerificeret mail på mednet.ucla.edu
Abass AlaviUPENNVerificeret mail på uphs.upenn.edu

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Kasper P. Kepp

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Computer modelling biological and medicinal data physical and biochemistry computational (bio)chemistry disease models


Titel Sortér efter henvisninger Sortér efter årstal Sortér efter titel	Citeret af Citeret af	År
Bioinorganic chemistry of Alzheimer’s disease KP Kepp Chemical reviews 112 (10), 5193-5239, 2012	694	2012
A quantitative scale of oxophilicity and thiophilicity KP Kepp Inorganic chemistry 55 (18), 9461-9470, 2016	443	2016
Halide, ammonium, and alkali metal ion parameters for modeling aqueous solutions KP Jensen, WL Jorgensen Journal of Chemical Theory and Computation 2 (6), 1499-1509, 2006	438	2006
Performance of density functionals for first row transition metal systems KP Jensen, BO Roos, U Ryde The Journal of chemical physics 126 (1), 2007	257	2007
How O2 binds to heme: reasons for rapid binding and spin inversion KP Jensen, U Ryde Journal of Biological Chemistry 279 (15), 14561-14569, 2004	208	2004
Theoretical prediction of the Co− C bond strength in cobalamins KP Jensen, U Ryde The Journal of Physical Chemistry A 107 (38), 7539-7545, 2003	206	2003
Consistent descriptions of metal–ligand bonds and spin-crossover in inorganic chemistry KP Kepp Coordination Chemistry Reviews 257 (1), 196-209, 2013	195	2013
Bioinorganic chemistry modeled with the TPSSh density functional KP Jensen Inorganic chemistry 47 (22), 10357-10365, 2008	172	2008
Accurate computed enthalpies of spin crossover in iron and cobalt complexes KP Jensen, J Cirera The Journal of Physical Chemistry A 113 (37), 10033-10039, 2009	168	2009
Metal ion enhanced binding of AMD3100 to Asp262 in the CXCR4 receptor LO Gerlach, JS Jakobsen, KP Jensen, MR Rosenkilde, RT Skerlj, U Ryde, ... Biochemistry 42 (3), 710-717, 2003	167	2003
Theoretical study of spin crossover in 30 iron complexes KP Kepp Inorganic Chemistry 55 (6), 2717-2727, 2016	165	2016
Alzheimer’s disease: How metal ions define β-amyloid function KP Kepp Coordination Chemistry Reviews 351, 127-159, 2017	150	2017
How the Co−C Bond Is Cleaved in Coenzyme B₁₂ Enzymes: A Theoretical Study KP Jensen, U Ryde Journal of the American Chemical Society 127 (25), 9117-9128, 2005	134	2005
A structural-chemical explanation of fungal laccase activity R Mehra, J Muschiol, AS Meyer, KP Kepp Scientific Reports 8 (1), 17285, 2018	129	2018
Characterization of an alkali-and halide-resistant laccase expressed in E. coli: CotA from Bacillus clausii S Brander, JD Mikkelsen, KP Kepp PLoS One 9 (6), e99402, 2014	128	2014
Alzheimer’s disease due to loss of function: A new synthesis of the available data KP Kepp Progress in neurobiology 143, 36-60, 2016	127	2016
O2-binding to heme: electronic structure and spectrum of oxyheme, studied by multiconfigurational methods KP Jensen, BO Roos, U Ryde Journal of inorganic biochemistry 99 (1), 45-54, 2005	116	2005
The dependence of amyloid‐β dynamics on protein force fields and water models AK Somavarapu, KP Kepp ChemPhysChem 16 (15), 3278-3289, 2015	109	2015
The chemical bond between transition metals and oxygen: electronegativity, d-orbital effects, and oxophilicity as descriptors of metal–oxygen interactions KA Moltved, KP Kepp The Journal of Physical Chemistry C 123 (30), 18432-18444, 2019	108	2019
Comment on "Density functional theory is straying from the path toward the exact functional" K Kepp Science 356 (6337), 496-497, 2017	106	2017

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