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In silico approach shows good predictability for free fraction in plasma and volume of distribution in human for drugs subjected to lysosomal trapping

Drug metabolism and pharmacokinetics, 2024-04, Vol.55, p.100899, Article 100899

2024

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Teaching of Biopharmaceutics in a Drug Design Course: Use of GastroPlus as Educational Software

Journal of chemical education, 2020-08, Vol.97 (8), p.2212-2220

2020

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Modeling of absorption

Methods in molecular biology (Clifton, N.J.), 2012, Vol.929, p.313

2012

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Calculations of antibody-antigen interactions: microscopic and semi-microscopic evaluation of the free energies of binding of phosphorylcholine analogs to McPC603

Protein engineering, design and selection, 1992, Vol.5 (3), p.215-228

1992

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Molecular Identification of a Role for Tyrosine 167 in the Function of the Human Intestinal Proton- Coupled Dipeptide Transporter (hPepT1)

Biochemical and biophysical research communications, 1998-09, Vol.250 (1), p.103-107

1998

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Thyroxine analogs. 23. Quantitative structure-activity correlation studies of in vivo and in vitro thyromimetic activities

Journal of medicinal chemistry, 1977-07, Vol.20 (7), p.863-880

1977

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Synthesis and in Vitro Activity of 3β-Substituted-3α-hydroxypregnan-20-ones: Allosteric Modulators of the GABAA Receptor

Journal of medicinal chemistry, 1997-01, Vol.40 (1), p.61-72

1997

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Simulations of Absorption, Metabolism, and Bioavailability

Drug Bioavailability, 2008, p.453-495

2008

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Proton-driven dipeptide uptake in primary cultured rabbit conjunctival epithelial cells

Investigative ophthalmology & visual science, 1998-11, Vol.39 (12), p.2365-2373

1998

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Statistical moment theory in chemical kinetics

Analytical chemistry (Washington), 1985-09, Vol.57 (11), p.2145-2151

1985

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Differential Responses of Expressed Recombinant Human γ‐Aminobutyric AcidA Receptors to Neurosteroids

Journal of neurochemistry, 1991-11, Vol.57 (5), p.1818-1821

1991

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Kinetics of association between bisquaternary ammonium ligands and acetylcholinesterase. Evidence for two conformational states of the enzyme from stopped-flow measurements of fluorescence

Biochemistry (Easton), 1979-08, Vol.18 (16), p.3622-3629

1979

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Exploiting chemical diversity for drug discovery

1, 2007

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Pressure-sensitive and -insensitive coupling in γ-aminobutyric acida receptors

Psychopharmacologia, 2001, Vol.157 (4), p.401-410

2001

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Identification and characterization of a pregnane steroid recognition site that is functionally coupled to an expressed GABAA receptor

Neurochemical research, 1991-03, Vol.16 (3), p.347-356

1991

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Use of Comfuter-Based Case Studies in a Problem-Solving Curriculum

American journal of pharmaceutical education, 1997, Vol.61 (1), p.97-102

1997

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[2] Computer modeling of combining site structure of anti-hapten monoclonal antibodies

Methods in Enzymology, 1991, Vol.203, p.21-45

1991

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Differential Responses of Expressed Recombinant Human γ‐Aminobutyric Acid A Receptors to Neurosteroids

Journal of neurochemistry, 1991-11, Vol.57 (5), p.1818-1821

1991

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Chapter 9 - Computational Techniques in Macromolecular Structural Analysis

Introduction to Biophysical Methods for Protein and Nucleic Acid Research, 1995, p.433-490

B. Bolger, Michael

1995

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Using molecular mimicry to produce anti-receptor antibodies

BioEssays, 1985-11, Vol.3 (5), p.213-217

1985

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Simulation of Absorption, Metabolism, and Bioavailability

Drug Bioavailability, 2003, p.420-443

2003

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Preparation and characterization of antisera and monoclonal antibodies to haloperdol

Immunological investigations, 1985, Vol.14 (6), p.523-540

1985

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The neuroactive steroid 3α-hydroxy-5β-pregnan-20-one is a two-component modulator of ligand binding to the GABAA receptor

European journal of pharmacology. Molecular pharmacology section, 1994-10, Vol.269 (2), p.157-163

1994

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In silico approach shows good predictability for free fraction in plasma and volume of distribution in human for drugs subjected to lysosomal trapping

Teaching of Biopharmaceutics in a Drug Design Course: Use of GastroPlus as Educational Software

Pathway-based predictive approaches for non-animal assessment of acute inhalation toxicity

Modeling of absorption

Calculations of antibody-antigen interactions: microscopic and semi-microscopic evaluation of the free energies of binding of phosphorylcholine analogs to McPC603

Molecular Identification of a Role for Tyrosine 167 in the Function of the Human Intestinal Proton- Coupled Dipeptide Transporter (hPepT1)

Pathway-Based Predictive Approaches for Non-Animal Assessment of Acute Inhalation Hazard Determination

Thyroxine analogs. 23. Quantitative structure-activity correlation studies of in vivo and in vitro thyromimetic activities

Synthesis and in Vitro Activity of 3β-Substituted-3α-hydroxypregnan-20-ones: Allosteric Modulators of the GABAA Receptor

Simulations of Absorption, Metabolism, and Bioavailability

Proton-driven dipeptide uptake in primary cultured rabbit conjunctival epithelial cells

Statistical moment theory in chemical kinetics

Differential Responses of Expressed Recombinant Human γ‐Aminobutyric AcidA Receptors to Neurosteroids

Kinetics of association between bisquaternary ammonium ligands and acetylcholinesterase. Evidence for two conformational states of the enzyme from stopped-flow measurements of fluorescence

Exploiting chemical diversity for drug discovery

Pressure-sensitive and -insensitive coupling in γ-aminobutyric acida receptors

Identification and characterization of a pregnane steroid recognition site that is functionally coupled to an expressed GABAA receptor

Use of Comfuter-Based Case Studies in a Problem-Solving Curriculum

[2] Computer modeling of combining site structure of anti-hapten monoclonal antibodies

Differential Responses of Expressed Recombinant Human γ‐Aminobutyric Acid A Receptors to Neurosteroids

Chapter 9 - Computational Techniques in Macromolecular Structural Analysis

Using molecular mimicry to produce anti-receptor antibodies

Simulation of Absorption, Metabolism, and Bioavailability

Preparation and characterization of antisera and monoclonal antibodies to haloperdol

The neuroactive steroid 3α-hydroxy-5β-pregnan-20-one is a two-component modulator of ligand binding to the GABAA receptor

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