Peter Comba
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(Suggest an Edit or Addition)Peter Comba's Published Works
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Total number of citations to an author for the works they published in a given year. This highlights publication of the most important work(s) by the author
Published Works
- Part I. Theory (2007) (488)
- Molecular modeling of inorganic compounds (1995) (181)
- Purple acid phosphatase: a journey into the function and mechanism of a colorful enzyme (2013) (159)
- Catalytic epoxidation and 1,2-dihydroxylation of olefins with bispidine-iron(II)/H2O2 systems. (2006) (130)
- Template syntheses involving carbon acids. Synthesis and characterization of (3,10-dimethyl-3,10-dinitro-1,4,8,11-tetraazacyclotetradecane)copper(II) and (1,9-diamino-5-methyl-5-nitro-3,7-diazanonane)copper(II) cations and nitro group reduction products (1986) (121)
- An oxocobalt(IV) complex stabilized by Lewis acid interactions with scandium(III) ions. (2011) (117)
- Biomimetic high-valent non-heme iron oxidants for the cis-dihydroxylation and epoxidation of olefins. (2007) (113)
- MOLECULAR MECHANICS CALCULATIONS OF TRANSITION-METAL COMPLEXES (1992) (108)
- Nonheme Oxoiron(IV) Complexes of Pentadentate N5 Ligands: Spectroscopy, Electrochemistry, and Oxidative Reactivity. (2013) (107)
- The relation between ligand structures, coordination stereochemistry, and electronic and thermodynamic properties (1993) (104)
- Cyanometalate-bridged oligonuclear transition metal complexes-Possibilities for a rational design of SMMs (2009) (93)
- Fit and misfit between ligands and metal ions (2003) (91)
- Bispidine Coordination Chemistry (2008) (88)
- Computational modelling of oxygenation processes in enzymes and biomimetic model complexes. (2014) (86)
- Formation of an aqueous oxoiron(IV) complex at pH 2-6 from a nonheme iron(II) complex and H2O2. (2006) (84)
- Hexadentate bispidine derivatives as versatile bifunctional chelate agents for copper(II) radioisotopes. (2009) (83)
- Interpretation of Electronic and EPR Spectra of Copper(II) Amine Complexes: A Test of the MM-AOM Method (1995) (82)
- Computation of structures and properties of transition metal compounds (2009) (80)
- Strains and stresses in coordination compounds (1999) (80)
- Proceedings of the Chemical Society. June 1958 (1958) (80)
- Direct Asymmetric Ruthenium-Catalyzed Reductive Amination of Alkyl-Aryl Ketones with Ammonia and Hydrogen. (2018) (76)
- The titanyl question revisited (1987) (76)
- Iron coordination chemistry with tetra-, penta- and hexadentate bispidine-type ligands (2002) (74)
- Oxidation of cyclohexane by high-valent iron bispidine complexes: tetradentate versus pentadentate ligands. (2009) (73)
- Iron-catalyzed halogenation of alkanes: modeling of nonheme halogenases by experiment and DFT calculations. (2010) (71)
- Coordination compounds in the entatic state (2000) (71)
- Abiotic methanogenesis from organosulphur compounds under ambient conditions (2014) (70)
- A new molecular mechanics force field for the oxidized form of blue copper proteins (2002) (70)
- Inorganic and bioinorganic molecular mechanics modeling—the problem of the force field parameterization (2003) (68)
- Structural studies on dicopper(II) compounds with catechol oxidase activity (2001) (68)
- Dinuclear zinc(II) complexes with hydrogen bond donors as structural and functional phosphatase models. (2014) (67)
- Calculation of exchange coupling constants of transition metal complexes with DFT. (2009) (67)
- Bispidine ligand effects on iron/hydrogen peroxide chemistry. (2004) (66)
- The mechanism of the (bispidine)copper(II)-catalyzed aziridination of styrene: a combined experimental and theoretical study. (2008) (65)
- Electron-transfer properties of an efficient nonheme iron oxidation catalyst with a tetradentate bispidine ligand. (2010) (65)
- Combined ligand field and density functional theory analysis of the magnetic anisotropy in oligonuclear complexes based on Fe(III)-CN-M(II) exchange-coupled pairs. (2008) (61)
- Molecular mechanics modeling of organic backbone of metal‐free and coordinated ligands (1998) (61)
- DFT models for copper(II) bispidine complexes: Structures, stabilities, isomerism, spin distribution, and spectroscopy (2006) (60)
- Structural variation in transition-metal bispidine compounds. (2002) (59)
- Copper-bispidine coordination chemistry: syntheses, structures, solution properties, and oxygenation reactivity. (2002) (59)
- Analysis of trigonal-prismatic and octahedral preferences in hexaamine cage complexes (1985) (59)
- Silver(I) complexes with phthalazine and quinazoline as effective agents against pathogenic Pseudomonas aeruginosa strains. (2016) (58)
- FMN-coated fluorescent iron oxide nanoparticles for RCP-mediated targeting and labeling of metabolically active cancer and endothelial cells. (2011) (58)
- Loop-Directed Mutagenesis of the Blue Copper Protein Amicyanin from Paracoccus versutus and Its Effect on the Structure and the Activity of the Type-1 Copper Site (2000) (57)
- Epoxidation and 1,2-dihydroxylation of alkenes by a nonheme iron model system - DFT supports the mechanism proposed by experiment. (2008) (55)
- Coordination chemistry of a new rigid, hexadentate bispidine-based bis(amine)tetrakis(pyridine) ligand. (2005) (55)
- Synthesis, magnetic properties, and phosphoesterase activity of dinuclear cobalt(II) complexes. (2013) (52)
- Determination of solution structures of binuclear copper(II) complexes (1992) (52)
- A density functional theory study of the reaction of the biomimetic iron(II) complex of a tetradentate bispidine ligand with H2O2. (2007) (52)
- Structure, bonding, and catecholase mechanism of copper bispidine complexes. (2012) (51)
- Trinuclear {M1}CN{M2}2 complexes (M1 = Cr(III), Fe(III), Co(III); M2 = Cu(II), Ni(II), Mn(II)). Are single molecule magnets predictable? (2008) (51)
- Influence of ligand architecture on oxidation reactions by high-valent nonheme manganese oxo complexes using water as a source of oxygen. (2015) (50)
- Modeling of the Redox Properties of (Hexaamine)cobalt(III/II) Couples. (1997) (49)
- Catalytic Aziridination of Styrene with Copper Complexes of Substituted 3,7‐Diazabicyclo[3.3.1]nonanones (2003) (49)
- Oxidation of cyclohexane by a high-valent iron bispidine complex: a combined experimental and computational mechanistic study. (2008) (48)
- Monoesterase activity of a purple acid phosphatase mimic with a cyclam platform. (2012) (48)
- Molecular mechanics and the Jahn-Teller effect (1994) (48)
- Bispidine copper(II) compounds: effects of the rigid ligand backbone. (2001) (47)
- Stabilization of Copper Dioxygen Compounds: Design, Synthesis, and Characterization (1999) (46)
- Stability constants: a new twist in transition metal bispidine chemistry. (2007) (46)
- Molecular Modeling and Dynamics of Bioinorganic Systems (1995) (45)
- The design of a new type of very rigid tetradentate ligand (1997) (45)
- Synthesis, structure, and highly efficient copper-catalyzed aziridination with a tetraaza-bispidine ligand. (2009) (45)
- Solid-State and Solution Structural Properties of Copper(I) Compounds with Bidentate Phosphane Ligands (1999) (45)
- The Directionality of d‐Orbitals and Molecular‐Mechanics Calculations of Octahedral Transition‐Metal Compounds (1995) (45)
- Spin-state ordering in hydroxo-bridged diiron(III)bisporphyrin complexes. (2015) (45)
- Octadentate Picolinic Acid-Based Bispidine Ligand for Radiometal Ions. (2017) (45)
- Removal of arsenic from wastewaters and stabilization of arsenic bearing waste solids: Summary of experimental studies (1995) (43)
- Prediction and interpretation of electronic spectra of transition metal complexes via the combination of molecular mechanics and angular overlap model calculations (1993) (43)
- Catecholase activity of dicopper(II)-bispidine complexes: stabilities and structures of intermediates, kinetics and reaction mechanism (2006) (43)
- DFT studies on the magnetic exchange across the cyanide bridge. (2006) (43)
- Comparisons of thirteen- to sixteen-membered tetra-azacycloalkane copper(II) complexes derived from template syntheses involving nitroethane and formaldehyde. Crystal structures of (10-methyl-10-nitro-1,4,8,12-tetra-azacyclopentadecane)copper(II) and (3-methyl-3-nitro-1,5,9,13-tetra-azacyclohexadeca (1988) (43)
- Tuning of the properties of transition-metal bispidine complexes by variation of the basicity of the aromatic donor groups. (2013) (42)
- Bond-stretch isomerism: trapped isomeric structures of hexacoordinate copper(II) bispidine chromophores along a Jahn-Teller active vibrational coordinate. (2003) (42)
- Catalytic oxidation of alkanes by iron bispidine complexes and dioxygen: oxygen activation versus autoxidation. (2014) (42)
- Tuning the Properties of Copper(II) Complexes with Tetra- and Pentadentate Bispidine (=3,7-Diazabicyclo[3.3.1]nonane) Ligands (2005) (41)
- Electronic structure of bispidine iron(IV) oxo complexes. (2007) (41)
- Metal ion selectivity and molecular modeling (1999) (41)
- Copper(II) coordination chemistry of westiellamide and its imidazole, oxazole, and thiazole analogues. (2008) (39)
- Synthesis and structural properties of patellamide A derivatives and their copper(II) compounds. (2002) (39)
- Synthesis and characterisation of manganese(II) compounds with tetradentate ligands based on the bispidine backbone (1998) (39)
- CopperII-mediated aromatic ortho-hydroxylation: a hybrid DFT and AB initio exploration. (2008) (38)
- A Thermally Populated, Perpendicularly Twisted Alkene Triplet Diradical. (2016) (38)
- The Solution Structure of a Copper(II) Compound of a New Cyclic Octapeptide by EPR Spectroscopy and Force Field Calculations. (1998) (38)
- Spectroscopic characterization of the active Fe(III)Fe(III) and Fe(III)Fe(II) forms of a purple acid phosphatase model system. (2012) (38)
- Coordination geometries of hexaamine cage complexes (1989) (38)
- Structural, EPR, and Electrochemical Studies of Binuclear Copper(II) Complexes of Bis(pentadentate) Ligands Derived from Bis(1,4,7-triazacyclonane) Macrocycles. (1998) (38)
- The three-electron heteropoly blue [P6Mo18O73]11- with a basket-shaped skeleton. (2004) (38)
- Optimization of pentadentate bispidines as bifunctional chelators for 64Cu positron emission tomography (PET). (2013) (38)
- Synthesis of a thirteen-membered tetra-azamacrocycle employing formaldehyde and nitroalkanes directed by metal ions. Crystal structures of (12-methyl-12-nitro-1,4,7,10-tetra-azacyclotridecane)copper(II) perchlorate and µ-chloro-1,1,1-trichloro-2-(12-methyl-12-nitro-1,4,7,10-tetra-azacyclotridecane)d (1988) (38)
- Synthesis of New Phenanthroline‐Based Heteroditopic Ligands – Highly Efficient and Selective Fluorescence Sensors for Copper(II) Ions (2006) (37)
- DFT-based studies on the Jahn-Teller effect in 3d hexacyanometalates with orbitally degenerate ground states. (2007) (36)
- Dinuclear metal(ii)-acetato complexes based on bicompartmental 4-chlorophenolate: syntheses, structures, magnetic properties, DNA interactions and phosphodiester hydrolysis. (2016) (35)
- Modeling of the various minima on the potential energy surface of bispidine copper(II) complexes: a further test for ligand field molecular mechanics. (2008) (35)
- Magnetic Interactions in a Series of Homodinuclear Lanthanide Complexes. (2015) (35)
- Molecular Mechanics Calculations and the Metal Ion Selective Extraction of Lanthanoids (1998) (35)
- SOLUTION STRUCTURES AND ISOMER DISTRIBUTIONS OF BIS(BETA -DIKETONATO) COMPLEXES OF TITANIUM(IV) AND COBALT(III) (1994) (34)
- Template synthesis of a tetraazamacrocyclic ligand with two pendant pyridinyl groups: properties of the isomers of the metal-free ligand and of their first-row transition metal compounds. (2001) (34)
- Zero-field splitting in a series of structurally related mononuclear Ni(II)-bispidine complexes. (2012) (33)
- A Bispidine Iron(IV)-Oxo Complex in the Entatic State. (2016) (33)
- Iron-catalysed oxidation and halogenation of organic matter in nature (2015) (33)
- A combined experimental and computational study on the sulfoxidation by high-valent iron bispidine complexes. (2011) (33)
- Riboflavin carrier protein-targeted fluorescent USPIO for the assessment of vascular metabolism in tumors. (2012) (33)
- Spin-crossover in an iron(III)-bispidine-alkylperoxide system. (2006) (32)
- In vivo evaluation of riboflavin receptor targeted fluorescent USPIO in mice with prostate cancer xenografts (2016) (31)
- Macrobicyclic chromium(III) hexaamine complexes (1986) (31)
- Modeling of molecular properties (2011) (31)
- Cyclic peptide marine metabolites and CuII. (2014) (30)
- Helical Figure-of-Eight Loop Dicopper(I) Compounds: Syntheses, Structures, and Dynamics. (1998) (30)
- An Approach to More Accurate Model Systems for Purple Acid Phosphatases (PAPs). (2015) (30)
- Bispidines for radiopharmaceuticals. (2018) (29)
- Tuning of inter- versus intrachain magnetic interactions in cyano-bridged Ni(II)/M(III) (M = Cr, Fe, Co) chain complexes. (2006) (29)
- Iron vs. ruthenium--a comparison of the stereoselectivity in catalytic olefin epoxidation. (2009) (29)
- Double Helical Dinuclear Copper(I) Complexes of Macrocyclic Bis(dithiadiimine) Ligands (1995) (28)
- The Ru(IV)=O-catalyzed sulfoxidation: a gated mechanism where O to S linkage isomerization switches between different efficiencies. (2010) (27)
- Bispidines for dual imaging. (2014) (27)
- Conformational searching of transition metal compounds (1999) (27)
- COORDINATION OF THE SEXIDENTATE MACROCYCLE 6,13-DIMETHYL-1,4,8,11-TETRAAZACYCLOTETRADECANE-6,13-DIAMINE TO IRON(III) (1991) (27)
- Relationship between chemical structure and mutagenic activity in some pesticides: the use of Salmonella typhimurium and Aspergillus nidulans (1977) (27)
- Bispidine dioxotetraaza macrocycles: a new class of bispidines for (64)Cu PET imaging. (2014) (26)
- Dioxygen reactivity of new bispidine-copper complexes. (2012) (26)
- Determination of the solution structures of melamine-based bis- and tris-macrocyclic ligand copper(II) complexes. (2006) (25)
- A New Mixed-Valence Mn(II)Mn(III) Compound With Catalase and Superoxide Dismutase Activities (2018) (25)
- Cyano-bridged homodinuclear copper(II) complexes. (2011) (25)
- Slow Electron Self‐Exchange in Spite of a Small Inner‐Sphere Reorganisation Energy − The Electron‐Transfer Properties of a Copper Complex with a Tetradentate Bispidine Ligand (2004) (25)
- Carbonic anhydrase activity of dinuclear Cu(II) complexes with patellamide model ligands. (2014) (25)
- Synthesis and Coordination Chemistry of Hexadentate Picolinic Acid Based Bispidine Ligands. (2016) (25)
- Solution Structures of Coordination Compounds (1994) (25)
- Synthesis and Cu(II) coordination chemistry of a patellamide derivative: consequences of the change from the natural thiazole/oxazoline to the artificial imidazole heterocycles. (2011) (24)
- Oxidative N-dealkylation in cobalt-bispidine-H2O2 systems. (2006) (24)
- Novel bispidine ligands and their first-row transition metal complexes: trigonal bipyramidal and trigonal prismatic geometries. (2009) (24)
- Transition metal complexes of the novel tridentate di-2-pyridylmethanamine (dipa) (1992) (24)
- Cu(II) coordination chemistry of patellamide derivatives: possible biological functions of cyclic pseudopeptides. (2012) (24)
- PREDICTION AND INTERPRETATION OF EPR SPECTRA OF LOW-SPIN IRON(III) COMPLEXES WITH THE MM-AOM METHOD (1994) (24)
- Axial bonds in copper(II) compounds (2001) (23)
- Novel RuII Complexes with Bispidine‐Based Bridging Ligands: Luminescence Sensing and Photocatalytic Properties (2010) (23)
- Encapsulation of cyanometalates by a tris-macrocyclic ligand tricopper(II) complex: syntheses, structural variation, and magnetic exchange coupling pathways. (2006) (23)
- Computation of cavity shapes, sizes, and plasticities (1999) (23)
- Dicopper(II) Complexes of Spiro Macrobicycles With Aza and Thia Aza Donor Sets (1990) (23)
- Inorganic Molecular Mechanics (1996) (23)
- Epr-Spectrum and Metal-Ligand Bonding Parameters of a Low-Spin (hexaamine)iron(iii) Complex (1991) (23)
- Tetrahedral Copper(II) Complexes with a Labile Coordination Site Supported by a Tris-tetramethylguanidinato Ligand. (2017) (23)
- Coordination of the "pendant-arm" macrocycle 6,13-diamino-6,13-dimethyl-1,4,8,11-tetraazacyclotetradecane to chromium(III). Crystal structure and physical properties of the hexacoordinated complex ion (1990) (23)
- Preparation, Structure, and Electronic Properties of a Low-Spin Iron(II) Hexaamine Compound. (1998) (22)
- Hybrid quantum mechanics/molecular mechanics studies of the active site of the blue copper proteins amicyanin and rusticyanin (2001) (22)
- N-Aryl Groups Are Ubiquitous in Cross-Dehydrogenative Couplings Because They Stabilize Reactive Intermediates. (2017) (22)
- Oxidation versus Dioxygenation of Catechol: The Iron–Bispidine System (2011) (22)
- PREORGANIZATION OF TETRATHIAMACROCYCLIC LIGANDS : IMPLICATIONS FROM COMPUTED AND EXPERIMENTALLY DETERMINED STRUCTURES (1997) (22)
- One-step template synthesis and solution structures of bis(macrocyclic) octaamine dicopper(II) complexes (1995) (21)
- Nonheme Iron-Oxo-Catalyzed Methane Formation from Methyl Thioethers: Scope, Mechanism, and Relevance for Natural Systems. (2017) (21)
- Stable five- and six-coordinate cobalt(III) complexes with a pentadentate bispidine ligand. (2008) (21)
- Synthesis and Oxidation of Vanadyl Complexes Containing Bispidine Ligands (2007) (20)
- Modeling of End-On (&mgr;-Peroxo)dicopper(II) Complexes. (1997) (20)
- Copper(II) complexes with aromatic nitrogen-containing heterocycles as effective inhibitors of quorum sensing activity in Pseudomonas aeruginosa (2016) (20)
- Reduction Potentials of Tetraaminecopper(II/I) Couples (1997) (20)
- Solid state and solution structures of two structurally related dicopper complexes with markedly different redox properties (1996) (20)
- Base hydrolysis of anionopentaamminecobalt(III) complexes: the role of ion association and the question of a common coordinatively unsaturated intermediate (1984) (20)
- A Very Rigid Bis-bispidine Tetraazamacrocycle and Its Unusual Copper(II) Complex. (2001) (20)
- Structural Variation of Dinuclear Transition Metal Compounds with a Common Type of Ligand: Solid State and Solution Structures and Model Studies (1999) (20)
- A Molecular‐Mechanics Analysis of Complexes of the Sexidentate Macrocycles cis‐ and trans‐6,13‐Dimethyl‐1,4,8,11‐tetraazacyclotetradecane‐6,13‐diamine (1991) (19)
- Energy-minimized structures and calculated and experimental isomer distributions in the hexaaminecobalt(III) system [Co(trap)2]3+ (trap=1,2,3-propanetriamine) (1988) (19)
- Structural and mechanistic studies of the copper(II)-assisted ortho-hydroxylation of benzoates by trimethylamine N-oxide (2002) (19)
- Dinuclear Copper(II) Complexes with Distant Metal Centers: Weaker Donor Groups Increase Catecholase Activity (2017) (19)
- The solution structure and reactivity of decavanadate (1988) (19)
- Phosphatase reactivity of a dicopper(II) complex of a patellamide derivative--possible biological functions of cyclic pseudopeptides. (2012) (19)
- Synthesis of a Cis-N2s2 Donor Macrocycle by Metal-Directed Condensation of Formaldehyde, Nitroethane and a Diaminodithiaalkane - Crystal-Structure of the (6-Methyl-6-Nitro-1,11-Dithia-4,8-Diazacyclotetradecane)-Copper(II) Perchlorate Product (1988) (19)
- Mutagenicity of chemicals of industry and agricultural relevance in Salmonella, Streptomyces and Aspergillus. (1981) (19)
- Template syntheses of chiral tetradentate ligands derived from L-amino acids. Structural and spectroscopic characterization of the free ligands and of their copper(II) complexes (1991) (19)
- Cadmium(II) complexes: mimics of organophosphate pesticide degrading enzymes and metallo-β-lactamases. (2012) (19)
- Structural properties of cyclopentanone-bridged bis-macrocyclic ligand dicopper(II) complexes in the solid and in solution: a successful test of the MM-EPR method. (2003) (19)
- Interpretation of the temperature-dependent color of blue copper protein mutants. (2004) (19)
- Interactions between Copper(II) Complexes of Mono-, Bis-, and Tris(macrocyclic) Ligands and Inorganic or Organic Guests (2002) (19)
- Template Synthesis, Crystal Structure, and Spectroscopic Characterization of [N,N′‐Bis(2‐pyridylmethylene)‐1,3‐diamino‐2‐methyl‐2‐nitropropane] copper(II) Perchlorate (1985) (18)
- A new molecular mechanics force field for the design of oxotechnetium(V) and oxorhenium(V) radiopharmaceuticals (2006) (18)
- Synthesis and transition metal coordination chemistry of a novel hexadentate bispidine ligand. (2015) (18)
- An amicyanin C-terminal loop mutant where the active-site histidine donor cannot be protonated (2000) (18)
- Ru0 or RuII: A Study on Stabilizing the "Activated" Form of Ru-PNP Complexes with Additional Phosphine Ligands in Alcohol Dehydrogenation and Ester Hydrogenation. (2020) (17)
- Transition Metal Coordination Compounds of Bisamidobispyridyl Ligands (1998) (17)
- Ensemble and Single-Molecule Studies on Fluorescence Quenching in Transition Metal Bipyridine-Complexes (2013) (16)
- Heterotrinuclear Complexes of the Platinum Group Metals with 2,2′-Biimidazole as a Bridging Ligand (2003) (16)
- Synthesis and characterization of a stable hexa-amine vanadium(IV) cage complex (1985) (16)
- Selective Coordination of Gallium(III), Zinc(II), and Copper(II) by an Asymmetric Dinucleating Ligand: A Model for Metallophosphatases. (2015) (16)
- Metal-Directed Synthesis of Macrocyclic Tetraamines With Pendant Nitro or Amine Groups, Based on trans-Cyclohexane-1,2-diamine (1994) (16)
- Complexation of cis-6,13-dimethyl-1,4,8,11-tetraazacyclotetradecane-6,13-diamine with the first row transition metal ions cobalt(III), chromium(III), and nickel(II) (1993) (16)
- An Unusual Cleavage and Macrocyclization in the Zinc-Aqueous Acid Reduction of [2-Methyl-2-Nitro-N,N'-Bis(Pyridin-2-Ylmethyl)-Propane-1,3-Diamine]Coppe R(II) Cation - Crystal-Structure of the (6,13-Dimethyl-1,4,8,11-Tetraazacyclotetradecane-6,13-Diamine)Copper(II) Perchlorate Product (1986) (16)
- Base Hydrolysis of Pentaaminecobalt(III) Complexes: The [CoX(dien) (dapo)]n+ system. Part 2. Structure and reactivity of the pentacoordinate intermediate (1992) (15)
- Cu 2+ selective chelators relieve copper-induced oxidative stress in vivo † (2018) (15)
- Zwitterionic Modification of Ultrasmall Iron Oxide Nanoparticles for Reduced Protein Corona Formation. (2017) (15)
- Dimerization of a copper(II) compound with a tetradentate diaminodiamide ligand (1999) (15)
- An examination of the binding behavior of histidine-containing peptides with immobilized metal complexes derived from the macrocyclic ligand, 1,4,7-triazacyclononane (2006) (15)
- Influence of Ligand Architecture in Tuning Reaction Bifurcation Pathways for Chlorite Oxidation by Non-Heme Iron Complexes. (2016) (15)
- Cyanide-bridged Fe(III)-Cu(II) complexes: Jahn-Teller isomerism and its influence on the magnetic properties. (2012) (15)
- Structure correlation in bispidine coordination compounds—isomerism and tuneable reactivity (2003) (15)
- The figure-of-eight twist to macrocycles: preorganization, self-organization and dynamics (1999) (14)
- Synthesis, Crystal Structure and Magnetism of a Macrocyclic Binuclear Dicopper(II) Amino Alcohol Complex From a Metal Directed Reaction Involving Formaldehyde and Nitroethane (1990) (14)
- TWO DIFFERENT TYPES OF FOLDING OF ISOMERIC MACROCYCLES INDUCED BY METAL ION CO-ORDINATION (1997) (14)
- Modeling of Molecular Properties: COMBA:PROPERTIES MODELING O-BK (2011) (14)
- Energy-Minimized Structures and Calculated and Experimental Isomer distributions in the hexaamine-cobalt(III) system [Co(L)2]3+ with the chiral facially-coordinating triamine (l = butane-1,2,4-triamine) (1989) (14)
- Versatile Bispidine‐Based Bifunctional Chelators for 64CuII‐Labelling of Biomolecules (2019) (14)
- Distortional isomerism with copper(I) complexes of 3,7-diazabicyclo[3.3.1]nonane derivatives. (2009) (14)
- Asymmetric mono- and dinuclear GaIII and ZnII complexes as models for purple acid phosphatases. (2016) (13)
- Isolation and complexation of the cis isomer of the pendant arm macrocycle 6,13-dimethyl-1,4,8,11-tetraazacyclotetradecane-6,13-diamine (1992) (13)
- Competing radical and non-radical pathways for the decomposition of LFeII(H2O2) complexes: a density functional study (2007) (13)
- Complex formation and stability of westiellamide derivatives with copper(II) (2010) (13)
- Insights into the electronic structure of Cu(II) bound to an imidazole analogue of westiellamide. (2014) (13)
- CHIRAL QUADRIDENTATE LIGANDS BASED ON AMINO-ACIDS - TEMPLATE SYNTHESES AND PROPERTIES OF THE FREE LIGANDS AND THEIR TRANSITION-METAL COMPLEXES (1993) (13)
- An efficient fluctuating charge model for transition metal complexes (2013) (13)
- Base Hydrolysis of Pentaaminecobalt (III) Complexes: The [CoX(dien) (dapo)]n+ system. Part 3. The internal conjugate base mechanism (1992) (13)
- Correlation of Structural and Magnetic Properties in a Set of Mononuclear Lanthanide Complexes. (2018) (12)
- Octadentate Oxine-Armed Bispidine Ligand for Radiopharmaceutical Chemistry. (2019) (12)
- Base Hydrolysis of Pentaaminecobalt(III) Complexes: The [CoX(dien) (dapo)]n+ system. Part 1. Syntheses, structures, configuration, and spectroscopy (1992) (12)
- Dinuclear ZnII and mixed CuII-ZnII complexes of artificial patellamides as phosphatase models. (2016) (12)
- Density functional investigation of metal-metal interactions in mixed-valence d2d3 (Cr, Mo, W) and d3d4 (Mn, Tc, Re) face-shared [M2Cl9]2- systems. (2004) (12)
- Chiral Tetraamines Based on (S)‐2‐(Aminomethyl)pyrrolidine: Template synthesis and properties of copper(II) complexes (1992) (12)
- Excited-state decay of the macrobicyclic hexaamine chromium(III) cage complexes Cr(III)sar3+ and Cr(III)diamsar3+ (1985) (12)
- The computation of lipophilicities of ⁶⁴Cu PET systems based on a novel approach for fluctuating charges. (2013) (12)
- Is CuII Coordinated to Patellamides inside Prochloron Cells? (2017) (11)
- Solution and solid state structures and magnetism of a series of linear trinuclear compounds with a hexacoordinate LnIII and two terminal NiII centers. (2016) (11)
- Optimization of the Efficiency of Oxidation Catalysts Based on Iron Bispidine Complexes (2011) (11)
- SOLUTION STRUCTURES OF A PAIR OF STABLE HEXAAMINECOBALT(III/II) CONFORMERS (1997) (11)
- Modeling of Structural and Spectroscopic Properties of Transition Metal Compounds (1996) (11)
- The Structure of an Isomeric Pair of a (Tetraamine)copper(II) Compound in the solid state and in solution (1997) (11)
- Structural variation in the copper(II) complexes with a tetradentate bis-6-methylpyridine-substituted bispidine ligand (2005) (11)
- First‐Generation Bispidine Chelators for 213BiIII Radiopharmaceutical Applications (2020) (10)
- Tuning of the properties of a picolinic acid-based bispidine ligand for stable copper(II) complexation (2017) (10)
- Redox Properties of Iron Complexes with Pentadentate Bispidine Ligands (2014) (10)
- The Role of the Apical Donor in the Decomposition of Copper(II) Benzoate under DOW-Phenol Conditions (2001) (10)
- Copper Solution Chemistry of Cyclic Pseudo‐Octapeptides (2013) (10)
- Formation of exocyclic olefinic groups via stereoselective nitrosations: a new route towards pendant arm macrocyclic ligands (1993) (9)
- Mono- and Dinuclear Copper(II) and Iron(II) Complexes of a Tetradentate Bispidine-diacetate Ligand (2009) (9)
- Structure and function (2010) (9)
- Bis-macrocyclic Ligands with Two Ferrocenyl End Groups, and Their Tetranuclear Dicopper(I) Compounds. (1999) (9)
- Complete Racemization in the Base Hydrolysis of Optically Active mer‐[Chloro(diethylene triamine) (1,3‐diaminopropan‐2‐ol‐N,N′) cobalt (III)]tetrachlorozincate (1980) (9)
- Structures, spectroscopy and modeling of a rare set of isomeric copper(II) complexes (2011) (9)
- Macrocyclic Melamine‐Based Ligand Complexes as Building Blocks for the Metal‐Directed Synthesis of Heterometallic Di‐ and Trinuclear Compounds (2003) (9)
- A Metal‐Free Direct Arene C−H Amination (2021) (9)
- Cu(II)-selective bispidine-dye conjugates. (2015) (9)
- Spin state and reactivity of iron(iv)oxido complexes with tetradentate bispidine ligands. (2020) (9)
- Predictions and methods of separation of racemic bidentate ligands via stereoselective ligand exchange reactions (1992) (9)
- Electron-Paramagnetic-Res Spectroscopy of a Trigonal Prismatic Vanadium Cage Complex - [1,8-Diammonio-3,6,10,13,16,19-hexaazabicyclo-[6.6.6]icosanato(3,6)vanadium(IV)](4+) (1986) (9)
- On the ground state Tg ⊗ εg (Tg = 2T2g, 3T1g) Jahn–Teller-coupling in hexacyano complexes of 3d-transition metals (2007) (9)
- Synthesis and Binding Properties of Dendritic Oxybathophenanthroline Ligands towards Copper(II) (2005) (8)
- Dinuclear Cobalt(II) Complexes as Metallo‐β‐lactamase Mimics (2013) (8)
- Theoretically Predicted and Experimentally Observed Relaxation Pathways of two Heterodinuclear 3d-4f Complexes †‡ (2015) (8)
- Glycosidase- and β-lactamase-like activity of dinuclear copper(II) patellamide complexes. (2016) (8)
- Hydrophilic oxybathophenanthroline ligands: synthesis and copper(II) complexation (2008) (8)
- Synthesis and Substitution Stereochemistry of trans-Chlorobis(Ethylenediamine)-(Trifluoromethanesulfonato)Cobalt(III) Trifluoromethanesulfonate (1986) (8)
- Excited State Properties of Lanthanide(III) Complexes with a Nonadentate Bispidine Ligand (2021) (8)
- Mechanistic Investigation of the Nickel-Catalyzed Carbonylation of Alcohols (2020) (7)
- Is the E2 mechanism required to explain base hydrolysis of cobalt(III) amine complexes in the limit of general base catalysis (1985) (7)
- Copper(II) chemistry of the functionalized macrocycle cyclam tetrapropionic acid. (2013) (7)
- The Ligand-Field Paradigm (2008) (7)
- Novel Ring Contraction Reaction for the Synthesis of Functionalized Tetrathiamacrocyclic Ligand Molecules. (1997) (7)
- A Structural and Functional Model for the Tris-Histidine Motif in Cysteine Dioxygenase. (2019) (7)
- Optimization of Hexadentate Bispidine Ligands as Chelators for 64 CuII PET Imaging. (2018) (7)
- Exceptional Manganese(II) Stability and Manganese(II)/Zinc(II) Selectivity with Rigid Polydentate Ligands (2022) (7)
- Protonation of the Copper(I) Form of the Blue Copper Proteins Plastocyanin and Amicyanin – A Molecular Dynamics Study (2000) (7)
- First row transition metal complexes of a hexadentate pyrazole-based bispidine ligand (2013) (7)
- Electronic interactions in ferrocene- and ruthenocene-functionalized tetraazamacrcocyclic ligand complexes of FeII/III, CoII, NiII, CuII and ZnII (2005) (7)
- Heteroatom‐Interchanged Isomers of Lissoclinamide 5: Copper(II) Complexation, Halide Binding, and Biological Activity (2018) (6)
- Synthesis, structural analysis, solution equilibria and biological activity of rhodium(III) complexes with a quinquedentate polyaminopolycarboxylate (2017) (6)
- Modeling of Macrocyclic Ligand Complexes (2005) (6)
- Chemistry by Number Theory (2013) (6)
- Stereoselective Coordination to Chiral Matrices. Cobalt(III). Chemistry of Simple Facially Coordinating Chiral Triamines (1990) (6)
- Non‐Heme‐Iron‐Mediated Selective Halogenation of Unactivated Carbon−Hydrogen Bonds (2021) (6)
- Ferro- and antiferromagnetic coupling in a chlorido-bridged, tetranuclear Cu(II) complex. (2014) (6)
- Geometrical isomerism in octahedral complexes arising from the presence of a fused ring on a triaza macrocycle (2003) (6)
- The Reactivity of Hexa(N-methylideneimine)CoIII Complexes towards Nucleophiles: Structure and Mechanism† (2006) (5)
- Mechanisms of C – H bond activation : rich synergy between computation and experiment (2009) (5)
- Characterization and Reactivity of a Tetrahedral Copper(II) Alkylperoxido Complex. (2019) (5)
- The Importance of Intra- and Intermolecular Weak Bonds in Transition Metal Coordination Compounds (1998) (5)
- Homogeneous Hydrogenation Catalyzed by Trinuclear RhI-OsIII-RhI Complexes (2003) (5)
- Isomerism in Copper(I)-Induced Folding of Homoditopic Macrocyclic Ligands with Bis(dithiadiimine) Donor Sets (1999) (5)
- A Simple New Structural Force Field for the Computation of Linear Metallocenes (1999) (5)
- A New Receptor of Aromatic Carboxylates Based on a Trismacrocyclic Complex of Copper(II) and Operating According to the Molecular Recognition Principle (2001) (5)
- Selective Decomposition of Cyclohexyl Hydroperoxide using Homogeneous and Heterogeneous CrVI Catalysts: Optimizing the Reaction by Evaluating the Reaction Mechanism (2018) (5)
- Oxidation Catalysis with High‐Valent Nonheme Iron Complexes (2014) (4)
- Structures, Electronics and Reactivity of Copper(II) Complexes of the Cyclic Pseudo -Peptides of the Ascidians (2017) (4)
- Catalytic Dehalogenation of Halogenated Pyridine Donors under DOW‐Phenol Conditions (2001) (4)
- Very stable CuII complexes of bispidines and their radiopharmaceutical behavior (2010) (4)
- Ligand-sensitized lanthanide(III) luminescence with octadentate bispidines (2019) (4)
- ELECTRONIC AND LIGAND STRUCTURE DICTATED EFFECTS FOR TRIGONAL, TETRAGONAL AND RHOMBIC SYMMETRIES OF TRANSITION METAL CAGE COMPLEXES (1986) (4)
- Modeling Structural, Spectroscopic and Redox Properties of Transition Metal Compounds (1999) (4)
- Oxidation of Cobalt(ii) Bispidine Complexes with Dioxygen (2017) (3)
- Synthesis, Magnetic Properties, and Catalytic Properties of a Nickel(II)-Dependent Biomimetic of Metallohydrolases (2018) (3)
- Phosphine-Catalyzed Vinylation at Low Acetylene Pressure. (2021) (3)
- Modeling of Structures and Molecular Properties of Transition Metal Compounds — Toward Metalloprotein Modeling (1997) (3)
- Cooperative Effects in the Binding of Substrates to Nickel(II) and Nickel(III) Complexes with a Bis(macrocyclic) Ligand (2002) (3)
- Molecular Mechanics Modeling of Transition Metal Compounds (1999) (3)
- Synthesis and characterization of copper complexes with a series of tripodal amine ligands (2019) (3)
- Computational Modelling of Oxygenation Processes in Enzymes and Biomimetic Model Complexes (2014) (3)
- Helical transition-metal compounds: preorganisation of the ligands by a paracyclophane group (1996) (3)
- Enforced Coordination Geometries — Preorganization, Catalysis and Beyond (2000) (3)
- Mutagenicity studies in Salmonella, Streptomyces, Aspergillus and unscheduled DNA synthesis in EUE cells of Paraquat and Diquat (1979) (3)
- Excitation of aryl cations as the key to catalyst-free radical arylations (2021) (3)
- Synthesis, physical properties and X-ray crystal structure of an oxovanadium(IV) complex of the pendant-arm macrocycle 6,13-dimethyl 1,4,8,11-tetra-azacyclotetradecane-6,13-diamine (1990) (3)
- Efficient Synthesis for a Wide Variety of Patellamide Derivatives and Phosphatase Activity of Copper‐Patellamide Complexes (2022) (3)
- Copper(II) Cyclam Complexes with N‐Propionic Acid Pendant Arms (2015) (3)
- Trends in Base Hydrolysis Rates of Chlorocobalt(III) Complexes of a Series of Related Pentaamine Ligands (2002) (3)
- Redox Potentials of High‐Valent Iron‐, Cobalt‐, and Nickel‐Oxido Complexes: Evidence for Exchange Enhanced Reactivity (2020) (3)
- Iron catalyzed demethylation of acetic acid* (2018) (2)
- Toward Personalized Medicine: One Chelator for Imaging and Therapy with Lutetium-177 and Actinium-225. (2022) (2)
- Possible Functional Roles of Patellamides in the Ascidian-Prochloron Symbiosis (2022) (2)
- The Titanyl Question Revisited. (1987) (2)
- Molecular modeling of transition metal and rare earth coordination compounds (2019) (2)
- Copper(II) and zinc(II) chemistry of a new hexadentate cyclam-based bis-di-2-pyridylmethanamine ligand (2011) (2)
- Molecular magnetic properties of a dysprosium(III) complex coordinated to a nonadentate bispidine ligand (2021) (2)
- Electronic Structure and Number Theory: Bohr’s Boldest Dream (2013) (2)
- Computational Approaches for Redox Potentials of Iron(IV)‐oxido Complexes (2020) (2)
- Resolution of racemic amino acids via stereoselective ligand-exchange reactions on an optically pure nickel(II) complex (1993) (2)
- Pathways of the Extremely Reactive Iron(IV)‐oxido complexes with Tetradentate Bispidine Ligands (2021) (2)
- Tuning of Structures and Properties of Bispidine Complexes (2009) (1)
- Synthesis, solid state and solution structures of two isomeric dicopper(II) complexes with functionalized azetidine ligands (2009) (1)
- Electronic Structure and Number Theory (2012) (1)
- Macrobicyclic Chromium(III) Hexaamine Complexes. (2002) (1)
- Interpretation and Prediction of Properties of Transition Metal Coordination Compounds (2011) (1)
- What controls the magnetic anisotropy in heptacoordinate high-spin cobalt(II) complexes? A theoretical perspective. (2022) (1)
- Molecular mechanics modeling of organic backbone of metal-free and coordinated ligands (1998) (1)
- New non-heme iron model compounds as catalysts in the oxidation of olefins (2003) (1)
- Intermediate-spin iron(IV)-oxido species with record reactivity. (2022) (1)
- Comprar Molecular Modeling of Inorganic Compounds, Third Edition | Peter Comba | 9783527317998 | Wiley (2007) (1)
- Magnetic Anisotropy in Cyanide Complexes of First Row Transition Metal Ions (2010) (1)
- The ascidian Lissoclinum patella, the patellamides and copper (2022) (1)
- A Density Functional Theory Study of the Reaction of the Biomimetic Iron ( II ) Complex of a Tetradentate Bispidine Ligand with H 2 O 2 (1)
- Bispidines as a platform for targeted multimodal imaging (2014) (0)
- Appendix 3: Software and Force Fields (2009) (0)
- Appendix 4: Books on Molecular Modeling and Reviews on Inorganic Molecular Modeling (2009) (0)
- Compounds with s‐, p‐, and f‐Block Elements (2007) (0)
- Second generation mimics for the enzyme purple acid phosphatase (2010) (0)
- Reactivities of iron(IV)-oxido compounds with pentadentate bispidine ligands. (2023) (0)
- Comparisons of Thirteen- to Sixteen-Membered Tetraazacycloalkane Copper(II) Complexes Derived from Template Syntheses Involving Nitroethane and Formaldehyde. Crystal Structures of (10-Methyl-10-nitro-1,4,8,12-tetraazacyclopentadecane) (1988) (0)
- The Impact of the Ability to Form Hydrogen Bonds on the Activity of Model Systems for Phosphoesterases (2014) (0)
- CCDC 1412103: Experimental Crystal Structure Determination (2017) (0)
- Density Functional Investigation of Metal—Metal Interactions in Mixed‐Valence d2d3 (Cr, Mo, W) and d3d4 (Mn, Tc, Re) Face‐Shared [M2Cl9]2‐ Systems. (2004) (0)
- Thomas J. Meade (Guest Editor), Astrid Sigel, Helmut Sigel, Eva Freisinger, Roland K. O. Sigel (Series Editors): Molecular Bio-Sensors and the Role of Metal Ions (2023) (0)
- Revisiting Nickel-Catalyzed Carbonylations: (Unexpected) Observation of Substrate-Dependent Mechanistic Differences (2022) (0)
- Fundamental Constants, Units and Conversion Factors (2007) (0)
- Bioinspired and biomimetic systems (2014) (0)
- Solution Structure and Reactivity of Decavanadate. (1988) (0)
- Template Syntheses Involving Carbon Acids. Synthesis and Characterization of (3,10-Dimethyl-3,10-dinitro-1,5,8,12-tetraazacyclotetradecane)copper(II) and (1,9-Diamino-5-methyl-5-nitro-3,7-diazanonane)copper(II) Cations and Nitro Group (1987) (0)
- Synthesis of a Thirteen-Membered Tetraazamacrocycle Employing Formaldehyde and Nitroalkanes Directed by Metal Ions. Crystal Structures of (12-Methyl-12-nitro-1,4,7,10-tetraazacyclotridecane)copper(II) Perchlorate and μ-Chloro-1,1,1-tr (1988) (0)
- Energy-Minimized Structures and Calculated and Experimental Isomer Distributions in the Hexaaminecobalt(III) System (Co(trap)2)3+ (trap: 1,2,3-Propanetriamine). (1989) (0)
- Structure Correlation in Bispidine Coordination Compounds: Isomerism and Tuneable Reactivity (2005) (0)
- Appendix 2: Fundamental Constants, Units, and Conversion Factors (2009) (0)
- Correlation of structures and reactivity of bispidine coordination compounds (2005) (0)
- The aim of this postdoc cooperation was the implementation of a crystal structure prediction module based on force field calculations in the molecular modeling software Momec (2012) (0)
- A novel molecular mechanics strategy for transition metals bound to biological molecules (1997) (0)
- Molecular Modeling Methods in Brief (2007) (0)
- Appendix 1: Glossary (2009) (0)
- Coordination Compounds: The Tetradentate Bispidine Ligand Dimethyl- (3,7-Dimethyl-9-Oxo-2,4-Bis(2-Pyridyl)-3,7- Diazabicyclo[3.3.1]Nonane)-1,5-Dicarboxylate and its Copper(II) Complex (2010) (0)
- Template Synthesis, Crystal Structure, and Spectroscopic Characterization of [N,N′-Bis(2-pyridylmethylene)-1,3-diamino-2-methyl-2-nitropropane]copper(II) Perchlorate. (1986) (0)
- A Bispidine based CuII/ZnII Heterobimetallic Coordination Polymer (2022) (0)
- Formation of Exocyclic Olefinic Groups via Stereoselective Nitrosations: A New Route Towards Pendant Arm Macrocyclic Ligands. (1993) (0)
- Part II. Applications (2007) (0)
- Modelling of the tyrosinase and phosphatase active sites by dinuclear N6O2-macrocyclic complexes (1995) (0)
- COMPLETE RACEMIZATION IN THE BASE HYDROLYSIS OF OPTICALLY ACTIVE MER-(CHLORO(DIETHYLENE TRIAMINE)(1,3-DIAMINOPROPAN-2-OL-N,N′) COBALT(III)) TETRACHLOROZINCATE (1980) (0)
- Interpreting and Using the Results (2007) (0)
- Are Single Molecule Magnets Predictable ? (2008) (0)
- The Effect of Jahn–Teller Coupling in Hexacyanometalates on the Magnetic Anisotropy in Cyanide-Bridged Single-Molecule Magnets (2009) (0)
- Empirical Charge Scheme for Transition Metals and Lanthanoids: Development and Applications (2018) (0)
- Helmholtz-Zentrum Dresden-Rossendorf (HZDR) Zwitterionic Modification of Ultra-Small Iron Oxide Nanoparticles for Reduced Protein Corona Formation (2020) (0)
- Bispidone ligands and their metal complexes (2007) (0)
- Cyclic peptide copper(II) coordination: Influence of conformation and ring size (2007) (0)
- An Engineered β‐Hairpin Peptide Forming Thermostable Complexes with ZnII, NiII, and CuII through a His3 Site (2022) (0)
- Metal Ion Selectivity (2007) (0)
- CCDC 878253: Experimental Crystal Structure Determination (2013) (0)
- CCDC 1412104: Experimental Crystal Structure Determination (2017) (0)
- Oxidation stabilized polyamide molding compounds (1996) (0)
- 1999 Minor Planet Amateur/Professional Workshop. Proceedings. (1999) (0)
- Solution structures of dinuclear copper(II) complexes (1995) (0)
- Radioactive metal complexes on the basis of Bispidine and its derivatives (2005) (0)
- Transition Metal Complexes of the Novel Tridentate Di-2- pyridylmethanamine (dipa). (1993) (0)
- Small molecule activation and synthetic analogues: general discussion. (2022) (0)
- DFT insights into the mechanism of O2 activation catalyzed by a structural and functional model of cysteine dioxygenase with tris(2-pyridyl)methane-based ligand architecture. (2022) (0)
- Carrying Out the Calculations (2007) (0)
- Chemical induction of streptomycine resistance in Streptomyces coelicolor (1978) (0)
- Recoveries, Follow-up Observations and Numbering of Minor Planets (1998) (0)
- Mn2+ Bispidine Complex Combining Exceptional Stability, Inertness, and MRI Efficiency. (2022) (0)
- Molecular Bio-Sensors and the Role of Metal Ions, Thomas J. Meade (Guest Editor), Astrid Sigel, Helmut Sigel, Eva Freisinger, Roland K. O. Sigel (Series Editors). Vol. 23 of Metal Ions in Life Sciences (2023) (0)
- 177LuIII- and 225AcIII-labelled bispidine-TATE conjugates: promising candidates for targeting neuroendocrine tumours (2022) (0)
- The Multiple Minima Problem (2007) (0)
- High‐Valent Non‐Heme Metal‐Oxygen Species (2020) (0)
- ESI and tandem MS for mechanistic studies with high-valent transition metal species. (2022) (0)
- Ligand Backbone Influence on the Enantioselectivity in the Ruthenium‐Catalyzed Direct Asymmetric Reductive Amination of Ketones with NH3/H2 Using Binaphthyl‐Substituted Phosphines (2022) (0)
- 177Lu-, 225Ac- and 111In-labelled nonadentate bispidine ligands: synthesis, radiolabelling experiments and stability assays (2022) (0)
- Synthesis, Physical Properties and X-Ray Crystal Structure of an Oxovanadium(IV) Complex of the Pendant-Arm Macrocycle 6,13-Dimethyl-1,4,8,11-tetra-azacyclotetradecane-6,13-diamine. (1990) (0)
- The Practice of Molecular Mechanics (2007) (0)
- Developing a Force Field (2007) (0)
- Binding site preference of Zn-II and Cu-II in cyclic pseudo-peptides promotes phosphoester hydrolysis activity (2014) (0)
- Template Syntheses of Chiral Tetradentate Ligands Derived from L-Amino Acids. Structural and Spectroscopic Characterization of the Free Ligands and of Their Copper(II) Complexes. (1991) (0)
- Versatile new bifunctional chelators for copper radionuclides (2010) (0)
- Computational Coordination Chemistry (2020) (0)
- Isolation and Complexation of the cis Isomer of the Pendant Arm Macrocycle 6,13-Dimethyl-1,4,8,11-tetraazacyclotetradecane-6,13- diamine. (2010) (0)
- Copper(II) Coordination chemistry of cyclic peptides (2007) (0)
- CaF₂-enhanced HCl leaching of a manganese-bearing silicate ore (1990) (0)
- Mechanistic studies on cytotoxic gold compounds (2014) (0)
- Validation of Ab‐Initio‐Predicted Magnetic Anisotropies and Magneto‐structural Correlations in Linear Hetero‐trinuclear DyIII‐NiII 2 Compounds (2021) (0)
- CCDC 809609: Experimental Crystal Structure Determination (2011) (0)
- Models for Isomeric Bispidine Complexes – Accurate Prediction Versus Thorough Understanding (2008) (0)
- Parameterization, Approximations and Limitations of Molecular Mechanics (2007) (0)
- Electron transfer, spectroscopy and theory: general discussion. (2022) (0)
- Correlations of electronic spectra and molecular structures of blue copper proteins (2003) (0)
- Parameterization, Approximations and Limitations (2007) (0)
- The Model, the Rules, and the Pitfalls (2007) (0)
- Part III. Practice of Molecular Mechanics (2007) (0)
- Cover Feature: Versatile Bispidine‐Based Bifunctional Chelators for 64 Cu II ‐Labelling of Biomolecules (Chem. Eur. J. 9/2020) (2020) (0)
- Gottfried Huttner (1937-2021): Intellectual Craftsman, Meaning Maker and Generalist. (2021) (0)
- Chiral Tetraamines Based on (S)-2-(Aminomethyl)pyrrolidine: Template Synthesis and Properties of Copper(II) Complexes. (1992) (0)
- Natural and artificial enzymes and medicinal aspects: general discussion. (2022) (0)
- A Very Rigid Bis-bispidine Tetraazamacrocycle and Its Unusual Copper(II) Complex This work was supported by the Deutsche Forschungsgemeinschaft (DFG). Bispidine=3,7-diazabicyclo (2001) (0)
- Software and Force Fields (2007) (0)
- Copper-bispidine catalyzed aziridination – a new twist in small molecule activation (2021) (0)
- Copper(II) coordination chemistry of pseudo cyclic peptides and their capacity to hydrolyse CO2 (2010) (0)
- Proceedings of the 4th bwHPC Symposium (2018) (0)
- NIR Absorbing Aromatic (Antiaromatic) Vinylogous Carbasapphyrins (3.3.1.0.1) with built-in Fused Dipolar Aromatic Hydrocarbon: Synthesis and Characterization (2021) (0)
- Minor Planet Observations [684 Prescott] (2006) (0)
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What Schools Are Affiliated With Peter Comba?
Peter Comba is affiliated with the following schools:
