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Influence of Solvent Polarity on Preferential Solvation of Molecular Recognition Probes in Solvent Mixtures

The journal of physical chemistry. B, 2012-12, Vol.116 (49), p.14433-14440

2012

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Field template-based design and biological evaluation of new sphingosine kinase 1 inhibitors

Breast cancer research and treatment, 2018-11, Vol.172 (1), p.33-43

2018

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Solvent Effects on Hydrogen Bonding

Angewandte Chemie (International ed.), 2007-01, Vol.46 (20), p.3706-3709

2007

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Structural Modification of the Antidepressant Mianserin Suggests That Its Anti-inflammatory Activity May Be Independent of 5-Hydroxytryptamine Receptors

Frontiers in immunology, 2019-05, Vol.10, p.1167-1167

2019

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Substituent effects on aromatic stacking interactions

Organic & biomolecular chemistry, 2007-01, Vol.5 (7), p.1062-1080

2007

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Interplay of Self-Association and Solvation in Polar Liquids

Journal of the American Chemical Society, 2013-08, Vol.135 (32), p.12091-12100

2013

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Preferential Solvation and Hydrogen Bonding in Mixed Solvents

Angewandte Chemie (International ed.), 2008-08, Vol.47 (33), p.6275-6277

2008

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Rationalizing the Activities of Diverse Cholecystokinin 2 Receptor Antagonists Using Molecular Field Points

Journal of medicinal chemistry, 2008-02, Vol.51 (3), p.565-573

2008

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Molecular recognition probes of solvation thermodynamics in solvent mixtures

Organic & biomolecular chemistry, 2011-11, Vol.9 (21), p.7571-7578

2011

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UK academic drug discovery

Nature reviews. Drug discovery, 2014-01, Vol.13 (1), p.15-16

2014

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Substituent Effects on Cation-π Interactions: A Quantitative Study

Proceedings of the National Academy of Sciences - PNAS, 2002-04, Vol.99 (8), p.4873-4876

2002

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Discovery and Characterization of Novel, Potent, Non-Peptide Parathyroid Hormone-1 Receptor Antagonists

Journal of medicinal chemistry, 2007-10, Vol.50 (20), p.4789-4792

2007

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Accurate structure prediction of biomolecular interactions with AlphaFold 3

Nature (London), 2024-06, Vol.630 (8016), p.493-500

2024

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Scaffold Hopping with Molecular Field Points: Identification of a Cholecystokinin-2 (CCK2) Receptor Pharmacophore and Its Use in the Design of a Prototypical Series of Pyrrole- and Imidazole-Based CCK2 Antagonists

Journal of medicinal chemistry, 2005-11, Vol.48 (22), p.6790-6802

2005

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Quantification of Functional Group Interactions in Transition States

Journal of the American Chemical Society, 2003-08, Vol.125 (33), p.9936-9937

2003

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The role of the counteranion in the cation-pi interaction

Chemical communications (Cambridge, England), 2003-04 (7), p.834-835

2003

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Noncovalent Assembly of [2]Rotaxane Architectures

Angewandte Chemie (International ed.), 2001-07, Vol.40 (14), p.2678-2682

2001

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An Evaluation of Force-Field Treatments of Aromatic Interactions

Chemistry : a European journal, 2002-07, Vol.8 (13), p.2860-2867

2002

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Novel, Achiral 1,3,4-Benzotriazepine Analogues of 1,4-Benzodiazepine-Based CCK2 Antagonists That Display High Selectivity over CCK1 Receptors

Journal of medicinal chemistry, 2006-04, Vol.49 (7), p.2253-2261

2006

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Optimization of the in Vitro and in Vivo Properties of a Novel Series of 2,4,5-Trisubstituted Imidazoles as Potent Cholecystokinin-2 (CCK2) Antagonists

Journal of medicinal chemistry, 2005-11, Vol.48 (22), p.6803-6812

2005

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2,7-Dioxo-2,3,4,5,6,7-hexahydro-1H-benzo[h][1,4]diazonine as a New Template for the Design of CCK2 Receptor Antagonists

Journal of medicinal chemistry, 2000-09, Vol.43 (19), p.3518-3529

2000

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Non-Peptide Cholecystokinin-B/Gastrin Receptor Antagonists Based on Bicyclic, Heteroaromatic Skeletons

Journal of medicinal chemistry, 1996-04, Vol.39 (9), p.1806-1815

1996

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Development of Peptide 3D Structure Mimetics: Rational Design of Novel Peptoid Cholecystokinin Receptor Antagonists

Journal of medicinal chemistry, 2000-09, Vol.43 (19), p.3505-3517

2000

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Influence of Solvent Polarity on Preferential Solvation of Molecular Recognition Probes in Solvent Mixtures

Field template-based design and biological evaluation of new sphingosine kinase 1 inhibitors

Solvent Effects on Hydrogen Bonding

Structural Modification of the Antidepressant Mianserin Suggests That Its Anti-inflammatory Activity May Be Independent of 5-Hydroxytryptamine Receptors

Substituent effects on aromatic stacking interactions

Interplay of Self-Association and Solvation in Polar Liquids

Preferential Solvation and Hydrogen Bonding in Mixed Solvents

MAP4K4 Inhibition Promotes Survival of Human Stem Cell-Derived Cardiomyocytes and Reduces Infarct Size In Vivo

Rationalizing the Activities of Diverse Cholecystokinin 2 Receptor Antagonists Using Molecular Field Points

Molecular recognition probes of solvation thermodynamics in solvent mixtures

UK academic drug discovery

Substituent Effects on Cation-π Interactions: A Quantitative Study

Discovery and Characterization of Novel, Potent, Non-Peptide Parathyroid Hormone-1 Receptor Antagonists

Accurate structure prediction of biomolecular interactions with AlphaFold 3

Scaffold Hopping with Molecular Field Points: Identification of a Cholecystokinin-2 (CCK2) Receptor Pharmacophore and Its Use in the Design of a Prototypical Series of Pyrrole- and Imidazole-Based CCK2 Antagonists

MAP4K4 Inhibition Promotes Survival of Human Stem Cell-Derived Cardiomyocytes and Reduces Infarct Size In Vivo

Quantification of Functional Group Interactions in Transition States

The role of the counteranion in the cation-pi interaction

Noncovalent Assembly of [2]Rotaxane Architectures

An Evaluation of Force-Field Treatments of Aromatic Interactions

Novel, Achiral 1,3,4-Benzotriazepine Analogues of 1,4-Benzodiazepine-Based CCK2 Antagonists That Display High Selectivity over CCK1 Receptors

Optimization of the in Vitro and in Vivo Properties of a Novel Series of 2,4,5-Trisubstituted Imidazoles as Potent Cholecystokinin-2 (CCK2) Antagonists

2,7-Dioxo-2,3,4,5,6,7-hexahydro-1H-benzo[h][1,4]diazonine as a New Template for the Design of CCK2 Receptor Antagonists

Non-Peptide Cholecystokinin-B/Gastrin Receptor Antagonists Based on Bicyclic, Heteroaromatic Skeletons

Development of Peptide 3D Structure Mimetics: Rational Design of Novel Peptoid Cholecystokinin Receptor Antagonists

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