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Role of the Heme Active Site and Protein Environment in Structure, Spectra, and Function of the Cytochrome P450s

Chemical reviews, 2000-02, Vol.100 (2), p.407-420

2000

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Theoretical Investigation of the Proton Assisted Pathway to Formation of Cytochrome P450 Compound I

Journal of the American Chemical Society, 1998-09, Vol.120 (35), p.8941-8948

1998

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Role of Protein Environment in Horseradish Peroxidase Compound I Formation: Molecular Dynamics Simulations of Horseradish Peroxidase−HOOH Complex

Journal of the American Chemical Society, 2000-01, Vol.122 (1), p.18-25

2000

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Structure and Spectra of Ferrous Dioxygen and Reduced Ferrous Dioxygen Model Cytochrome P450

Journal of the American Chemical Society, 1998-05, Vol.120 (18), p.4308-4318

1998

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Identification of Putative Peroxide Intermediates of Peroxidases by Electronic Structure and Spectra Calculations

Journal of the American Chemical Society, 1996-10, Vol.118 (43), p.10588-10594

1996

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Prediction of Regiospecific Hydroxylation of Camphor Analogs by Cytochrome P450cam

Journal of the American Chemical Society, 1995-03, Vol.117 (10), p.2738-2746

1995

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Rational Design, Discovery, and Synthesis of a Novel Series of Potent Growth Hormone Secretagogues

Journal of medicinal chemistry, 2001-11, Vol.44 (24), p.4082-4091

2001

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Molecular determinants of non-specific recognition of δ, μ, and κ opioid receptors

Bioorganic & medicinal chemistry, 2001, Vol.9 (1), p.69-76

2001

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Probing the Role of Protein Environment in Compound I Formation of Chloroperoxidase (CPO)

Journal of the American Chemical Society, 2000-04, Vol.122 (15), p.3599-3605

2000

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Determinants of the spin state of the resting state of cytochrome P450cam

Journal of the American Chemical Society, 1993-09, Vol.115 (19), p.8775-8779

1993

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Influence of benzodiazepine binding site ligands on fear-conditioned contextual memory

European journal of pharmacology, 2001-08, Vol.426 (1), p.45-54

2001

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Development of a 3D pharmacophore for nonspecific ligand recognition of α1, α2, α3, α5, and α6 containing gaba A /benzodiazepine receptors

Bioorganic & medicinal chemistry, 2000-07, Vol.8 (7), p.1799-1807

2000

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Investigation of the Proton-Assisted Pathway to Formation of the Catalytically Active, Ferryl Species of P450s by Molecular Dynamics Studies of P450eryF

Journal of the American Chemical Society, 1996-07, Vol.118 (27), p.6377-6387

1996

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An ab Initio Model System Investigation of the Proposed Mechanism for Activation of Peroxidases: Cooperative Catalytic Contributions from the Ion and Microsolvent Water

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 1998-12, Vol.102 (50), p.10380-10384

1998

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Identification of the binding site on cytochrome P450 2B4 for cytochrome b5 and cytochrome P450 reductase

The Journal of biological chemistry, 1998-07, Vol.273 (27), p.17036

1998

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Determinants of recognition of ligands binding to benzodiazepine receptor/GABA A receptors initiating sedation

European journal of pharmacology, 2000-08, Vol.401 (3), p.271-287

2000

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A Role for Thr 252 in Cytochrome P450cam Oxygen Activation

Journal of the American Chemical Society, 1994-12, Vol.116 (26), p.11671-11674

1994

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Characterization of novel benzodiazepine ligands in Spodotera frugiperda (Sf-9) insect cells

Neuroscience letters, 2001-06, Vol.306 (1), p.25-28

2001

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Structure and Relative Spin-State Energetics of [Fe(H2O)6]3+: A Comparison of UHF, Møller−Plesset, Nonlocal DFT, and Semiempircal INDO/S Calculations

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 1997-05, Vol.101 (21), p.3959-3965

1997

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Valproic acid metabolism by cytochrome P450: a theoretical study of stereoelectronic modulators of product distribution

Journal of the American Chemical Society, 1991-03, Vol.113 (7), p.2736-2743

1991

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A Theoretical Study of Benzhydroxamic Acid Binding Modes in Horseradish Peroxidase

Journal of the American Chemical Society, 1998-06, Vol.120 (21), p.5168-5178

1998

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Structure, spectra, and function of heme sites

International journal of quantum chemistry, 2000, Vol.77 (1), p.54-70

Loew, Gilda

2000

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Reaction Mechanisms of Formaldehyde with Endocyclic Imino Groups of Nucleic Acid Bases

Journal of the American Chemical Society, 1994-04, Vol.116 (8), p.3548-3555

1994

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Theoretical and experimental analysis of the absolute stereochemistry of cis-.beta.-methylstyrene epoxidation by cytochrome P450cam

Journal of the American Chemical Society, 1991-04, Vol.113 (8), p.3195-3196

1991

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An intermediate neglect of differential overlap technique for spectroscopy of transition-metal complexes. Ferrocene

Journal of the American Chemical Society, 1980-01, Vol.102 (2), p.589-599

1980

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Role of the Heme Active Site and Protein Environment in Structure, Spectra, and Function of the Cytochrome P450s

Theoretical Investigation of the Proton Assisted Pathway to Formation of Cytochrome P450 Compound I

Role of Protein Environment in Horseradish Peroxidase Compound I Formation: Molecular Dynamics Simulations of Horseradish Peroxidase−HOOH Complex

Structure and Spectra of Ferrous Dioxygen and Reduced Ferrous Dioxygen Model Cytochrome P450

Identification of Putative Peroxide Intermediates of Peroxidases by Electronic Structure and Spectra Calculations

Prediction of Regiospecific Hydroxylation of Camphor Analogs by Cytochrome P450cam

Rational Design, Discovery, and Synthesis of a Novel Series of Potent Growth Hormone Secretagogues

Molecular determinants of non-specific recognition of δ, μ, and κ opioid receptors

Probing the Role of Protein Environment in Compound I Formation of Chloroperoxidase (CPO)

Determinants of the spin state of the resting state of cytochrome P450cam

Influence of benzodiazepine binding site ligands on fear-conditioned contextual memory

Development of a 3D pharmacophore for nonspecific ligand recognition of α1, α2, α3, α5, and α6 containing gaba A /benzodiazepine receptors

Investigation of the Proton-Assisted Pathway to Formation of the Catalytically Active, Ferryl Species of P450s by Molecular Dynamics Studies of P450eryF

An ab Initio Model System Investigation of the Proposed Mechanism for Activation of Peroxidases: Cooperative Catalytic Contributions from the Ion and Microsolvent Water

Identification of the binding site on cytochrome P450 2B4 for cytochrome b5 and cytochrome P450 reductase

Determinants of recognition of ligands binding to benzodiazepine receptor/GABA A receptors initiating sedation

A Role for Thr 252 in Cytochrome P450cam Oxygen Activation

Characterization of novel benzodiazepine ligands in Spodotera frugiperda (Sf-9) insect cells

Structure and Relative Spin-State Energetics of [Fe(H2O)6]3+: A Comparison of UHF, Møller−Plesset, Nonlocal DFT, and Semiempircal INDO/S Calculations

Valproic acid metabolism by cytochrome P450: a theoretical study of stereoelectronic modulators of product distribution

A Theoretical Study of Benzhydroxamic Acid Binding Modes in Horseradish Peroxidase

Structure, spectra, and function of heme sites

Reaction Mechanisms of Formaldehyde with Endocyclic Imino Groups of Nucleic Acid Bases

Theoretical and experimental analysis of the absolute stereochemistry of cis-.beta.-methylstyrene epoxidation by cytochrome P450cam

An intermediate neglect of differential overlap technique for spectroscopy of transition-metal complexes. Ferrocene

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