4.6 Article

Biological and computational evaluation of resveratrol inhibitors against Alzheimer's disease

相关参考文献

注意:仅列出部分参考文献,下载原文获取全部文献信息。
Article Chemistry, Medicinal

Structure-based design of novel dihydroisoquinoline BACE-1 inhibitors that do not engage the catalytic aspartates

Simeon Bowers et al.

BIOORGANIC & MEDICINAL CHEMISTRY LETTERS (2013)

Article Toxicology

Acrolein induces Alzheimer's disease-like pathologies in vitro and in vivo

Ying-Juan Huang et al.

TOXICOLOGY LETTERS (2013)

Article Biochemistry & Molecular Biology

Structure-activity relationships for naturally occurring coumarins as β-secretase inhibitor

Shinsuke Marumoto et al.

BIOORGANIC & MEDICINAL CHEMISTRY (2012)

Review Biochemistry & Molecular Biology

Flavonoids, cognition, and dementia: Actions, mechanisms, and potential therapeutic utility for Alzheimer disease

Robert J. Williams et al.

FREE RADICAL BIOLOGY AND MEDICINE (2012)

Article Chemistry, Medicinal

Combining Dyad Protonation and Active Site Plasticity in BACE-1 Structure-Based Drug Design

Puneet Kacker et al.

JOURNAL OF CHEMICAL INFORMATION AND MODELING (2012)

Article Chemistry, Medicinal

Chemical Modification of the Multitarget Neuroprotective Compound Fisetin

Chandramouli Chiruta et al.

JOURNAL OF MEDICINAL CHEMISTRY (2012)

Review Biochemistry & Molecular Biology

Developing ß-secretase inhibitors for treatment of Alzheimer's disease

Arun K. Ghosh et al.

JOURNAL OF NEUROCHEMISTRY (2012)

Article Biochemistry & Molecular Biology

Neuroprotective Effect of Natural Products Against Alzheimer's Disease

Musthafa M. Essa et al.

NEUROCHEMICAL RESEARCH (2012)

Article Chemistry, Medicinal

Inhibition and structural reliability of prenylated flavones from the stem bark of Morus lhou on β-secretase (BACE-1)

Jung Keun Cho et al.

BIOORGANIC & MEDICINAL CHEMISTRY LETTERS (2011)

Review Pharmacology & Pharmacy

Alzheimer's disease & metals: therapeutic opportunities

Vijaya B. Kenche et al.

BRITISH JOURNAL OF PHARMACOLOGY (2011)

Article Chemistry, Physical

PROPKA3: Consistent Treatment of Internal and Surface Residues in Empirical pKa Predictions

Mats H. M. Olsson et al.

JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2011)

Article Biochemistry & Molecular Biology

Quantum mechanics study of the hydroxyethylamines-BACE-1 active site interaction energies

Carlos Gueto-Tettay et al.

JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN (2011)

Article Plant Sciences

New Guaiane Sesquiterpene Lactones from Ixeris dentata

Mi-Ran Cha et al.

PLANTA MEDICA (2011)

Article Chemistry, Medicinal

β-Secretase (BACE-1) inhibitory effect of biflavonoids

Hiroaki Sasaki et al.

BIOORGANIC & MEDICINAL CHEMISTRY LETTERS (2010)

Article Chemistry, Medicinal

Tautomer Preference in PDB Complexes and its Impact on Structure-Based Drug Discovery

Francesca Milletti et al.

JOURNAL OF CHEMICAL INFORMATION AND MODELING (2010)

Article Chemistry, Medicinal

Identification of a small molecule beta-secretase inhibitor that binds without catalytic aspartate engagement

Thomas G. Steele et al.

BIOORGANIC & MEDICINAL CHEMISTRY LETTERS (2009)

Article Chemistry, Multidisciplinary

Substrate Binding Mechanism of HIV-1 Protease from Explicit-Solvent Atomistic Simulations

Fabio Pietrucci et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2009)

Article Plant Sciences

A New Specific BACE-1 Inhibitor from the Stembark Extract of Vitis vinifera

Yeon Hee Choi et al.

PLANTA MEDICA (2009)

Article Biochemistry & Molecular Biology

Predicting drug resistance of the HIV-1 protease using molecular interaction energy components

Tingjun Hou et al.

PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS (2009)

Article Biochemistry & Molecular Biology

Flavonols and flavones as BACE-1 inhibitors: Structure-activity relationship in cell-free, cell-based and in silico studies reveal novel pharmacophore features

Yoshiari Shimmyo et al.

BIOCHIMICA ET BIOPHYSICA ACTA-GENERAL SUBJECTS (2008)

Article Biochemistry & Molecular Biology

Design, synthesis and SAR of potent statine-based BACE-1 inhibitors: Exploration of P1 phenoxy and benzyloxy residues

Marcus Back et al.

BIOORGANIC & MEDICINAL CHEMISTRY (2008)

Article Biochemistry & Molecular Biology

BACE1 inhibitory effects of lavandulyl flavanones from Sophora flavescens

Eun Mi Hwang et al.

BIOORGANIC & MEDICINAL CHEMISTRY (2008)

Article Chemistry, Multidisciplinary

Rapid and accurate prediction of binding free energies for saquinavir-bound HIV-1 proteases

Ileana Stoica et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2008)

Article Biochemistry & Molecular Biology

Very fast prediction and rationalization of pKa values for protein-ligand complexes

Delphine C. Bas et al.

PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS (2008)

Article Chemistry, Medicinal

New and original pKa prediction method using grid molecular interaction fields

Francesca Milletti et al.

JOURNAL OF CHEMICAL INFORMATION AND MODELING (2007)

Article Plant Sciences

β-secretase (BACE1)-inhibiting stilbenoids from Smilax Rhizoma

S.-Y. Jeon et al.

PHYTOMEDICINE (2007)

Article Biochemistry & Molecular Biology

Comparison of multiple amber force fields and development of improved protein backbone parameters

Viktor Hornak et al.

PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS (2006)

Article Chemistry, Medicinal

Extra precision glide: Docking and scoring incorporating a model of hydrophobic enclosure for protein-ligand complexes

Richard A. Friesner et al.

JOURNAL OF MEDICINAL CHEMISTRY (2006)

Article Chemistry, Physical

Assigning the protonation states of the key aspartates in β-secretase using QM/MM X-ray structure refinement

Ning Yu et al.

JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2006)

Article Chemistry, Medicinal

β-secretase (BACE1) inhibitors from pomegranate (Punica granatum) husk

HM Kwak et al.

ARCHIVES OF PHARMACAL RESEARCH (2005)

Article Biochemistry & Molecular Biology

Resveratrol promotes clearance of Alzheimer's disease amyloid-β peptides

P Marambaud et al.

JOURNAL OF BIOLOGICAL CHEMISTRY (2005)

Article Chemistry, Multidisciplinary

Development and testing of a general amber force field

JM Wang et al.

JOURNAL OF COMPUTATIONAL CHEMISTRY (2004)

Article Biochemistry & Molecular Biology

Apo and inhibitor complex structures of BACE (β-secretase)

S Patel et al.

JOURNAL OF MOLECULAR BIOLOGY (2004)

Article Chemistry, Medicinal

Modeling the protonation states of the catalytic aspartates in β-secretase

R Rajamani et al.

JOURNAL OF MEDICINAL CHEMISTRY (2004)

Article Chemistry, Medicinal

Green tea catechins as a BACE1 (β-secretase) inhibitor

SY Jeon et al.

BIOORGANIC & MEDICINAL CHEMISTRY LETTERS (2003)

Article Biophysics

Protocol for MM/PBSA molecular dynamics simulations of proteins

F Fogolari et al.

BIOPHYSICAL JOURNAL (2003)

Article Biochemistry & Molecular Biology

Specificity of resistance to oxidative stress

R Dargusch et al.

JOURNAL OF NEUROCHEMISTRY (2002)

Article Chemistry, Physical

Langevin stabilization of molecular dynamics

JA Izaguirre et al.

JOURNAL OF CHEMICAL PHYSICS (2001)

Review Chemistry, Multidisciplinary

Calculating structures and free energies of complex molecules: Combining molecular mechanics and continuum models

PA Kollman et al.

ACCOUNTS OF CHEMICAL RESEARCH (2000)

Article Chemistry, Medicinal

Predicting blood-brain barrier permeation from three-dimensional molecular structure

P Crivori et al.

JOURNAL OF MEDICINAL CHEMISTRY (2000)

Article Chemistry, Physical

Molecular fields in quantitative structure-permeation relationships: the VolSurf approach

C Cruciani et al.

JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM (2000)

Article Biochemistry & Molecular Biology

The Protein Data Bank

HM Berman et al.

NUCLEIC ACIDS RESEARCH (2000)