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Theoretical and Computational Photochemistry: Fundamentals, Methods, Applications and Synergy with Experimental Approaches

1, 2023

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Synthesis, spectroscopic, structural and conformational study of some tri-substituted ureas derived from N-methylpiperazine containing phenyl and N-heterocyclic substituents

Journal of molecular structure, 2013-07, Vol.1044, p.215-220

2013

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Synthesis, structural, conformational and pharmacological study of some carbamates derived from 8-methyl-8-azabicyclo[3.2.1]octan-3α-ol

Journal of molecular structure, 2011-12, Vol.1006 (1), p.508-512

2011

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Synthesis, structural, conformational and pharmacological study of some amides derived from 3 -methyl-2,4-diphenyl-3-azabicyclo[3.3.1]nonan-9α-amine

Journal of molecular structure, 2010-07, Vol.976 (1), p.190-195

2010

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Synthesis, structural and conformational study of some esters derived from 3-methyl-3-azabicyclo[3.2.1]octan-8(α and β)-ols

Journal of molecular structure, 2014-09, Vol.1073, p.31-36

2014

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Contilisant, a Tetratarget Small Molecule for Alzheimer’s Disease Therapy Combining Cholinesterase, Monoamine Oxidase Inhibition, and H3R Antagonism with S1R Agonism Profile

Journal of medicinal chemistry, 2018-08, Vol.61 (15), p.6937-6943

2018

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The 5-HT3 and nACh Ionotropic Receptors: A Perspective from the Computational Chemistry Point of View

Current medicinal chemistry, 2002-01, Vol.9 (1), p.99-125

2002

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Ligand-receptor interaction at the neural nicotinic acetylcholine binding site: a theoretical model

Journal of molecular graphics & modelling, 2002-10, Vol.21 (2), p.111-118

2002

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Synthesis, structural, conformational and pharmacological study of some carbamates derived from 8-methyl-8-azabicyclo[3.2.1]octan-3I+/--ol

Journal of molecular structure, 2011-12, Vol.1006 (1-3), p.508-512

2011

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Multipotent cholinesterase/monoamine oxidase inhibitors for the treatment of Alzheimer's disease: design, synthesis, biochemical evaluation, ADMET, molecular modeling, and QSAR analysis of novel donepezil-pyridyl hybrids

Drug design, development and therapy, 2014-01, Vol.8 (default), p.1893-1910

2014

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Synthesis, structural and conformational study of 3-methyl-3-azabicyclo[3.2.1]octan-8-one and 3-methyl-3-azabicyclo[3.3.1]nonan-9-one oximes

Journal of molecular structure, 2003-06, Vol.651, p.579-583

2003

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Infrared analysis and molecular structure of α-aminonitriles derived from 1-azaadamantan-4-one

Journal of molecular structure, 2003-06, Vol.651, p.593-599

2003

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Nitric oxide blocks hKv1.5 channels by S-nitrosylation and by a cyclic GMP-dependent mechanism

Cardiovascular research, 2006-10, Vol.72 (1), p.80-89

2006

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Spectroscopic study of 3-methyl-3-azabicyclo[3.2.1]octan-8α (and β)-ols

Journal of molecular structure, 2001-05, Vol.563, p.535-537

2001

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Synthesis, structural, conformational and pharmacological study of some carbamates derived from 3-methyl-2,4-diphenyl-3-azabicyclo[3.3.1]nonan-9β-ol

Journal of molecular structure, 1999-05, Vol.482-483, p.437-442

1999

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Synthesis, structural and conformational study of some ureas derived from 3-methyl-2,4-diphenyl-3-azabicyclo[3.3.1]nonan-9β-amine

Journal of molecular structure, 1999-05, Vol.482-483, p.431-436

1999

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Synthesis of 2′-Arylazabicyclo-3-spiro-4′(5′)-imidazolines

Synthesis (Stuttgart), 1994, Vol.1994 (8), p.832-836

1994

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Structural, conformational and pharmacological study of some amides derived from 3-methyl-2,4-diphenyl-3-azabicyclo[3.3.1]nonan-9β-amine as potential analgesics

Journal of molecular structure, 1999-05, Vol.482-483, p.425-430

1999

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Synthesis, structural and conformational study of some amides derived from N-methylpiperazine

Journal of molecular structure, 2006-04, Vol.787 (1), p.8-13

2006

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Synthesis, structural and conformational study of some amides derived from 3-methyl-3-azabicyclo[3.2.1]octan-8α(β)-amines

Journal of molecular structure, 2008-08, Vol.886 (1), p.59-65

2008

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Synthesis and Structural, Conformational, Biochemical, and Pharmacological Study of New Compounds Derived from Tropane-3-spiro-4’(5’)-imidazoline as Potential 5-HT3 Receptor Antagonists

Journal of pharmaceutical sciences, 1995-01, Vol.84 (1), p.101-106

1995

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Spectroscopic study of 3-methyl-2,4-diphenyl-3-azabicyclo[3.3.1]nonan-9-α(β)-ols

Journal of heterocyclic chemistry, 1992-03, Vol.29 (2), p.519-521

1992

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Part IV: Synergy with experimental approaches

Theoretical and Computational Photochemistry, 2023

2023

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Part I: Fundamentals

Theoretical and Computational Photochemistry, 2023

2023

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Part II: Methods

Theoretical and Computational Photochemistry, 2023

2023

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Theoretical and Computational Photochemistry: Fundamentals, Methods, Applications and Synergy with Experimental Approaches

Synthesis, spectroscopic, structural and conformational study of some tri-substituted ureas derived from N-methylpiperazine containing phenyl and N-heterocyclic substituents

Synthesis, structural, conformational and pharmacological study of some carbamates derived from 8-methyl-8-azabicyclo[3.2.1]octan-3α-ol

Synthesis, structural, conformational and pharmacological study of some amides derived from 3 -methyl-2,4-diphenyl-3-azabicyclo[3.3.1]nonan-9α-amine

Synthesis, structural and conformational study of some esters derived from 3-methyl-3-azabicyclo[3.2.1]octan-8(α and β)-ols

Contilisant, a Tetratarget Small Molecule for Alzheimer’s Disease Therapy Combining Cholinesterase, Monoamine Oxidase Inhibition, and H3R Antagonism with S1R Agonism Profile

The 5-HT3 and nACh Ionotropic Receptors: A Perspective from the Computational Chemistry Point of View

Ligand-receptor interaction at the neural nicotinic acetylcholine binding site: a theoretical model

Synthesis, structural, conformational and pharmacological study of some carbamates derived from 8-methyl-8-azabicyclo[3.2.1]octan-3I+/--ol

Multipotent cholinesterase/monoamine oxidase inhibitors for the treatment of Alzheimer's disease: design, synthesis, biochemical evaluation, ADMET, molecular modeling, and QSAR analysis of novel donepezil-pyridyl hybrids

Synthesis, structural and conformational study of 3-methyl-3-azabicyclo[3.2.1]octan-8-one and 3-methyl-3-azabicyclo[3.3.1]nonan-9-one oximes

Infrared analysis and molecular structure of α-aminonitriles derived from 1-azaadamantan-4-one

Nitric oxide blocks hKv1.5 channels by S-nitrosylation and by a cyclic GMP-dependent mechanism

Spectroscopic study of 3-methyl-3-azabicyclo[3.2.1]octan-8α (and β)-ols

Synthesis, structural, conformational and pharmacological study of some carbamates derived from 3-methyl-2,4-diphenyl-3-azabicyclo[3.3.1]nonan-9β-ol

Synthesis, structural and conformational study of some ureas derived from 3-methyl-2,4-diphenyl-3-azabicyclo[3.3.1]nonan-9β-amine

Synthesis of 2′-Arylazabicyclo-3-spiro-4′(5′)-imidazolines

Structural, conformational and pharmacological study of some amides derived from 3-methyl-2,4-diphenyl-3-azabicyclo[3.3.1]nonan-9β-amine as potential analgesics

Synthesis, structural and conformational study of some amides derived from N-methylpiperazine

Synthesis, structural and conformational study of some amides derived from 3-methyl-3-azabicyclo[3.2.1]octan-8α(β)-amines

Synthesis and Structural, Conformational, Biochemical, and Pharmacological Study of New Compounds Derived from Tropane-3-spiro-4’(5’)-imidazoline as Potential 5-HT3 Receptor Antagonists

Spectroscopic study of 3-methyl-2,4-diphenyl-3-azabicyclo[3.3.1]nonan-9-α(β)-ols

Part IV: Synergy with experimental approaches

Part I: Fundamentals

Part II: Methods

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