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Mapping potential energy surfaces

The Journal of chemical physics, 2004-07, Vol.121 (3), p.1193-1200

2004

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Exploring the nature of molecular recognition in nicotinic acetylcholine receptors

Current medicinal chemistry, 2000-08, Vol.7 (8), p.749

Schmitt, J D

2000

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Cytotoxic oplopane sesquiterpenoids from Arnoglossum atriplicifolium

Natural product research, 2016-09, Vol.30 (18), p.2028-2033

2016

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Diterpenoids and acetylenic lipids from Aralia racemosa

Biochemical systematics and ecology, 2013-12, Vol.51, p.4-7

2013

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QSAR modeling of mono- and bis-quaternary ammonium salts that act as antagonists at neuronal nicotinic acetylcholine receptors mediating dopamine release

Bioorganic & medicinal chemistry, 2006-05, Vol.14 (9), p.3017-3037

2006

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Supervised Self-Organizing Maps in Drug Discovery. 1. Robust Behavior with Overdetermined Data Sets

Journal of chemical information and modeling, 2005-11, Vol.45 (6), p.1749-1758

2005

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AhpF Can Be Dissected into Two Functional Units: Tandem Repeats of Two Thioredoxin-like Folds in the N-Terminus Mediate Electron Transfer from the Thioredoxin Reductase-like C-Terminus to AhpC

Biochemistry (Easton), 2000-06, Vol.39 (22), p.6602-6615

2000

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2-(Arylmethyl)-3-substituted quinuclidines as selective α7 nicotinic receptor ligands

Bioorganic & medicinal chemistry letters, 2005-04, Vol.15 (8), p.2073-2077

2005

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Biosynthetic conversion of phosphatidylglycerol to sn-1:sn-1' bis(monoacylglycerol) phosphate in a macrophage-like cell Line

Biochemistry (Easton), 1995-04, Vol.34 (16), p.5554-5560

1995

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Molecular Recognition in Nicotinic Acetylcholine Receptors: The Importance of π−Cation Interactions

Journal of medicinal chemistry, 1999-08, Vol.42 (16), p.3066-3074

1999

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Supervised Self-Organizing Maps in Drug Discovery. 2. Improvements in Descriptor Selection and Model Validation

Journal of chemical information and modeling, 2006-01, Vol.46 (1), p.137-144

2006

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Orbital Energetics and Molecular Recognition

Journal of the American Chemical Society, 2006-04, Vol.128 (14), p.4514-4515

2006

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Molecular modeling of mono- and bis-quaternary ammonium salts as ligands at the α4β2 nicotinic acetylcholine receptor subtype using nonlinear techniques

The AAPS journal, 2005-09, Vol.7 (3), p.E678-E685

2005

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Genetic algorithms and self-organizing maps: a powerful combination for modeling complex QSAR and QSPR problems

Journal of computer-aided molecular design, 2004-07, Vol.18 (7-9), p.483-493

2004

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Targacept Active Conformation Search: A New Method for Predicting the Conformation of a Ligand Bound to Its Protein Target

Journal of medicinal chemistry, 2004-12, Vol.47 (27), p.6831-6839

2004

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Protonation-induced stereoisomerism in nicotine: conformational studies using classical (AMBER) and ab initio (Car-Parrinello) molecular dynamics

Journal of computer-aided molecular design, 2005-01, Vol.19 (1), p.1-15

2005

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Ferrocenoyl Derivatives of Alamethicin: Redox-Sensitive Ion Channels

Biochemistry (Easton), 1997-02, Vol.36 (5), p.1115-1122

1997

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Reaction of Oxidized CuZnSOD with Polyphenols

Natural science (Irvine, Calif.), 2016, Vol.8 (8), p.359-379

2016

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2-(Arylmethyl)-3-substituted quinuclidines as selective alpha 7 nicotinic receptor ligands

Bioorganic & medicinal chemistry letters, 2005-04, Vol.15 (8), p.2073-2077

2005

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Regulation of rat hepatic lipase by the composition of monomolecular films of lipid

Biochemistry (Easton), 1993-06, Vol.32 (22), p.5752-5758

1993

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Molecular modeling of mono- and bis-quaternary ammonium salts as ligands at the alpha4beta2 nicotinic acetylcholine receptor subtype using nonlinear techniques

The AAPS journal, 2005-10, Vol.7 (3), p.E678-E685

2005

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Molecular modeling of mono- and bis-quaternary ammonium salts as ligands at the alpha 4 beta 2 nicotinic acetylcholine receptor subtype using nonlinear techniques

The AAPS journal, 2005-01, Vol.7 (3), p.E678-E685

2005

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Propranolol, a phosphatidate phosphohydrolase inhibitor, also inhibits protein kinase C

The Journal of biological chemistry, 1992-10, Vol.267 (28), p.20481-20488

1992

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Conversion of 1-O-[3H]alkyl-2-arachidonoyl-sn-glycero-3-phosphorylcholine to lyso platelet-activating factor by the CoA-independent transacylase in membrane fractions of human neutrophils

The Journal of biological chemistry, 1991-10, Vol.266 (28), p.18691-18698

1991

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Chapter 5. Targeting nicotinic acetylcholine receptors: Advances in molecular design and therapies

Annual Reports in Medicinal Chemistry, 2000, Vol.35, p.41-51

2000

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Mapping potential energy surfaces

Exploring the nature of molecular recognition in nicotinic acetylcholine receptors

Cytotoxic oplopane sesquiterpenoids from Arnoglossum atriplicifolium

Diterpenoids and acetylenic lipids from Aralia racemosa

QSAR modeling of mono- and bis-quaternary ammonium salts that act as antagonists at neuronal nicotinic acetylcholine receptors mediating dopamine release

Supervised Self-Organizing Maps in Drug Discovery. 1. Robust Behavior with Overdetermined Data Sets

AhpF Can Be Dissected into Two Functional Units: Tandem Repeats of Two Thioredoxin-like Folds in the N-Terminus Mediate Electron Transfer from the Thioredoxin Reductase-like C-Terminus to AhpC

2-(Arylmethyl)-3-substituted quinuclidines as selective α7 nicotinic receptor ligands

Biosynthetic conversion of phosphatidylglycerol to sn-1:sn-1' bis(monoacylglycerol) phosphate in a macrophage-like cell Line

Molecular Recognition in Nicotinic Acetylcholine Receptors: The Importance of π−Cation Interactions

Supervised Self-Organizing Maps in Drug Discovery. 2. Improvements in Descriptor Selection and Model Validation

Orbital Energetics and Molecular Recognition

Molecular modeling of mono- and bis-quaternary ammonium salts as ligands at the α4β2 nicotinic acetylcholine receptor subtype using nonlinear techniques

Genetic algorithms and self-organizing maps: a powerful combination for modeling complex QSAR and QSPR problems

Targacept Active Conformation Search: A New Method for Predicting the Conformation of a Ligand Bound to Its Protein Target

Protonation-induced stereoisomerism in nicotine: conformational studies using classical (AMBER) and ab initio (Car-Parrinello) molecular dynamics

Ferrocenoyl Derivatives of Alamethicin: Redox-Sensitive Ion Channels

Reaction of Oxidized CuZnSOD with Polyphenols

2-(Arylmethyl)-3-substituted quinuclidines as selective alpha 7 nicotinic receptor ligands

Regulation of rat hepatic lipase by the composition of monomolecular films of lipid

Molecular modeling of mono- and bis-quaternary ammonium salts as ligands at the alpha4beta2 nicotinic acetylcholine receptor subtype using nonlinear techniques

Molecular modeling of mono- and bis-quaternary ammonium salts as ligands at the alpha 4 beta 2 nicotinic acetylcholine receptor subtype using nonlinear techniques

Propranolol, a phosphatidate phosphohydrolase inhibitor, also inhibits protein kinase C

Conversion of 1-O-[3H]alkyl-2-arachidonoyl-sn-glycero-3-phosphorylcholine to lyso platelet-activating factor by the CoA-independent transacylase in membrane fractions of human neutrophils

Chapter 5. Targeting nicotinic acetylcholine receptors: Advances in molecular design and therapies

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