List of works - Alan C Gibbs

A cluster-based strategy for assessing the overlap between large chemical libraries and its application to a recent acquisition

scientific article published in November 2006

Analysis of the Structural and Molecular Basis of Voltage-sensitive Sodium Channel Inhibition by the Spider Toxin Huwentoxin-IV ( -TRTX-Hh2a)

scientific article

Comparison of automated docking programs as virtual screening tools

scientific article

Conformational sampling of bioactive molecules: a comparative study

scientific article

Correction to Inhibitors of Ketohexokinase: Discovery of Pyrimidinopyrimidines with Specific Substitution that Complements the ATP-Binding Site

scholarly article published in ACS Medicinal Chemistry Letters

Cycloaddition reactions of thiazolium azomethine ylides: application to pyrrolo[2,1-b]thiazoles

scientific article

Design, synthesis, and biological evaluation of (2R,alphaS)-3,4-dihydro-2-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]-5-[3-(trifluoromethoxy)-phenyl]-alpha-(trifluoromethyl)-1(2H)-quinolineethanol as potent and orally active cholesteryl ester transfer pro

scientific article

Discovery of novel potent imidazo[1,2-b]pyridazine PDE10a inhibitors

scientific article

Docking: successes and challenges

scientific article

Electron density guided fragment-based drug design--a lead generation example

scientific article

Electron density guided fragment-based lead discovery of ketohexokinase inhibitors

scientific article

Elements and modulation of functional dynamics

scientific article

Fusion to a highly stable consensus albumin binding domain allows for tunable pharmacokinetics

scientific article

Identification of 2-acylaminothiophene-3-carboxamides as potent inhibitors of FLT3.

scientific article

Inhibitor Bound Dengue NS2B-NS3pro Reveals Multiple Dynamic Binding Modes

scientific article published on 15 February 2018

Inhibitors of Ketohexokinase: Discovery of Pyrimidinopyrimidines with Specific Substitution that Complements the ATP-Binding Site

scientific article

Insensitivity to pain induced by a potent selective closed-state Nav1.7 inhibitor

scientific article

NMR solution structure of the precursor for carnobacteriocin B2, an antimicrobial peptide from Carnobacterium piscicola

scientific article published in May 2004

Nanosecond temperature jump relaxation dynamics of cyclic beta-hairpin peptides.

scientific article published in June 2003

Optimization of a pyrazole hit from FBDD into a novel series of indazoles as ketohexokinase inhibitors

scientific article

Probing the structural determinants of type II' beta-turn formation in peptides and proteins

scientific article

Processing of small molecule databases for automated docking

scientific article

Pyrimidinopyrimidine inhibitors of ketohexokinase: exploring the ring C2 group that interacts with Asp-27B in the ligand binding pocket

scientific article

Quantum mechanical pairwise decomposition analysis of protein kinase B inhibitors: validating a new tool for guiding drug design

scientific article

Synthesis and identification of [1,2,4]thiadiazole derivatives as a new series of potent and orally active dual agonists of peroxisome proliferator-activated receptors alpha and delta

scientific article

Synthesis and structure-activity relationships of thiadiazole-derivatives as potent and orally active peroxisome proliferator-activated receptors alpha/delta dual agonists

scientific article

Unusual β-sheet periodicity in small cyclic peptides

scientific article published on April 1, 1998

List of works by Alan C Gibbs

A cluster-based strategy for assessing the overlap between large chemical libraries and its application to a recent acquisition

Analysis of the Structural and Molecular Basis of Voltage-sensitive Sodium Channel Inhibition by the Spider Toxin Huwentoxin-IV ( -TRTX-Hh2a)

Comparison of automated docking programs as virtual screening tools

Conformational sampling of bioactive molecules: a comparative study

Correction to Inhibitors of Ketohexokinase: Discovery of Pyrimidinopyrimidines with Specific Substitution that Complements the ATP-Binding Site

Cycloaddition reactions of thiazolium azomethine ylides: application to pyrrolo[2,1-b]thiazoles

Design, synthesis, and biological evaluation of (2R,alphaS)-3,4-dihydro-2-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]-5-[3-(trifluoromethoxy)-phenyl]-alpha-(trifluoromethyl)-1(2H)-quinolineethanol as potent and orally active cholesteryl ester transfer pro

Discovery of novel potent imidazo[1,2-b]pyridazine PDE10a inhibitors

Docking: successes and challenges

Electron density guided fragment-based drug design--a lead generation example

Electron density guided fragment-based lead discovery of ketohexokinase inhibitors

Elements and modulation of functional dynamics

Fusion to a highly stable consensus albumin binding domain allows for tunable pharmacokinetics

Identification of 2-acylaminothiophene-3-carboxamides as potent inhibitors of FLT3.

Inhibitor Bound Dengue NS2B-NS3pro Reveals Multiple Dynamic Binding Modes

Inhibitors of Ketohexokinase: Discovery of Pyrimidinopyrimidines with Specific Substitution that Complements the ATP-Binding Site

Insensitivity to pain induced by a potent selective closed-state Nav1.7 inhibitor

NMR solution structure of the precursor for carnobacteriocin B2, an antimicrobial peptide from Carnobacterium piscicola

Nanosecond temperature jump relaxation dynamics of cyclic beta-hairpin peptides.

Optimization of a pyrazole hit from FBDD into a novel series of indazoles as ketohexokinase inhibitors

Probing the structural determinants of type II' beta-turn formation in peptides and proteins

Processing of small molecule databases for automated docking

Pyrimidinopyrimidine inhibitors of ketohexokinase: exploring the ring C2 group that interacts with Asp-27B in the ligand binding pocket

Quantum mechanical pairwise decomposition analysis of protein kinase B inhibitors: validating a new tool for guiding drug design

Synthesis and identification of [1,2,4]thiadiazole derivatives as a new series of potent and orally active dual agonists of peroxisome proliferator-activated receptors alpha and delta

Synthesis and structure-activity relationships of thiadiazole-derivatives as potent and orally active peroxisome proliferator-activated receptors alpha/delta dual agonists

Unusual β-sheet periodicity in small cyclic peptides