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。Allosteric signaling in C-linker and cyclic nucleotide-binding domain of HCN2 channels
Christopher Pfleger et al.
BIOPHYSICAL JOURNAL (2021)
Structure and gating mechanism of the α7 nicotinic acetylcholine receptor
Colleen M. Noviello et al.
CELL (2021)
Structural basis of human α7 nicotinic acetylcholine receptor activation
Yue Zhao et al.
CELL RESEARCH (2021)
Molecular determinants of binding of non-oxime bispyridinium nerve agent antidote compounds to the adult muscle nAChR
Max Epstein et al.
TOXICOLOGY LETTERS (2021)
ff19SB: Amino-Acid-Specific Protein Backbone Parameters Trained against Quantum Mechanics Energy Surfaces in Solution
Chuan Tian et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2020)
Synthetic antibodies against BRIL as universal fiducial marks for single-particle cryoEM structure determination of membrane proteins
Somnath Mukherjee et al.
NATURE COMMUNICATIONS (2020)
Structure of the Native Muscle-type Nicotinic Receptor and Inhibition by Snake Venom Toxins
Md. Mahfuzur Rahman et al.
NEURON (2020)
Cell Type-Dependent Escape of Capsid Inhibitors by Simian Immunodeficiency Virus SIVcpz
Augustin Penda Twizerimana et al.
JOURNAL OF VIROLOGY (2020)
Shared structural mechanisms of general anaesthetics and benzodiazepines
Jeong Joo Kim et al.
NATURE (2020)
PACKMOL-Memgen: A Simple-To-Use, Generalized Workflow for Membrane-Protein-Lipid-Bilayer System Building
Stephan Schott-Verdugo et al.
JOURNAL OF CHEMICAL INFORMATION AND MODELING (2019)
Agonist Selectivity and Ion Permeation in the α3β4 Ganglionic Nicotinic Receptor
Anant Gharpure et al.
NEURON (2019)
Converging a Knowledge-Based Scoring Function: DrugScore(2018)
Jonas Dittrich et al.
JOURNAL OF CHEMICAL INFORMATION AND MODELING (2019)
GABAA receptor signalling mechanisms revealed by structural pharmacology
Simonas Masiulis et al.
NATURE (2019)
An allosteric binding site of the α7 nicotinic acetylcholine receptor revealed in a humanized acetylcholine-binding protein
Florian Delbart et al.
JOURNAL OF BIOLOGICAL CHEMISTRY (2018)
Improvements to the APBS biomolecular solvation software suite
Elizabeth Jurrus et al.
PROTEIN SCIENCE (2018)
Electrophysiological investigation of the effect of structurally different bispyridinium non-oxime compounds on human α7-nicotinic acetylcholine receptor activity-An in vitro structure-activity analysis
Corinna Scheffel et al.
TOXICOLOGY LETTERS (2018)
Development of MS Binding Assays targeting the binding site of MB327 at the nicotinic acetylcholine receptor
S. Sichler et al.
TOXICOLOGY LETTERS (2018)
In vitro pharmacological characterization of the bispyridinium non-oxime compound MB327 and its 2-and 3-regioisomers
K. V. Niessen et al.
TOXICOLOGY LETTERS (2018)
Searching for putative binding sites of the bispyridinium compound MB327 in the nicotinic acetylcholine receptor
Thomas Wein et al.
TOXICOLOGY LETTERS (2018)
TopScore: Using Deep Neural Networks and Large Diverse Data Sets for Accurate Protein Model Quality Assessment
Daniel Mulnaes et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2018)
Structural principles of distinct assemblies of the human α4β2 nicotinic receptor
Richard M. Walsh et al.
NATURE (2018)
Synthesis of a Series of Non-Symmetric Bispyridinium and Related Compounds and Their Affinity Characterization at the Nicotinic Acetylcholine Receptor
Sebastian Rappenglueck et al.
CHEMMEDCHEM (2018)
Ensemble- and Rigidity Theory-Based Perturbation Approach To Analyze Dynamic Allostery
Christopher Pfleger et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2017)
CAVER: Algorithms for Analyzing Dynamics of Tunnels in Macromolecules
Antonin Pavelka et al.
IEEE-ACM TRANSACTIONS ON COMPUTATIONAL BIOLOGY AND BIOINFORMATICS (2016)
X-ray structure of the human α4β2 nicotinic receptor
Claudio L. Morales-Perez et al.
NATURE (2016)
Functional analysis of Torpedo californica nicotinic acetylcholine receptors in multiple activation states by SSM-based electrophysiology
K. V. Niessen et al.
TOXICOLOGY LETTERS (2016)
Long-Time-Step Molecular Dynamics through Hydrogen Mass Repartitioning
Chad W. Hopkins et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2015)
Molecular blueprint of allosteric binding sites in a homologue of the agonist-binding domain of the α7 nicotinic acetylcholine receptor
Radovan Spurny et al.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2015)
Absolute Quantitative 1H NMR Spectroscopy for Compound Purity Determination
Mark Cushman et al.
JOURNAL OF MEDICINAL CHEMISTRY (2014)
Importance of Purity Evaluation and the Potential of Quantitative 1H NMR as a Purity Assay
Guido F. Pauli et al.
JOURNAL OF MEDICINAL CHEMISTRY (2014)
Building Water Models: A Different Approach
Saeed Izadi et al.
JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2014)
Affinities of bispyridinium non-oxime compounds to [3H]epibatidine binding sites of Torpedo californica nicotinic acetylcholine receptors depend on linker length
K. V. Niessen et al.
CHEMICO-BIOLOGICAL INTERACTIONS (2013)
Limitations and challenges in treatment of acute chemical warfare agent poisoning
Horst Thiermann et al.
CHEMICO-BIOLOGICAL INTERACTIONS (2013)
Multisite Binding of a General Anesthetic to the Prokaryotic Pentameric Erwinia chrysanthemi Ligand-gated Ion Channel (ELIC)
Radovan Spurny et al.
JOURNAL OF BIOLOGICAL CHEMISTRY (2013)
Constraint Network Analysis (CNA): A Python Software Package for Efficiently Linking Biomacromolecular Structure, Flexibility, (Thermo-)Stability, and Function
Christopher Pfleger et al.
JOURNAL OF CHEMICAL INFORMATION AND MODELING (2013)
PTRAJ and CPPTRAJ: Software for Processing and Analysis of Molecular Dynamics Trajectory Data
Daniel R. Roe et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2013)
Global and Local Indices for Characterizing Biomolecular Flexibility and Rigidity
Christopher Pfleger et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2013)
Experimental determination of the vertical alignment between the second and third transmembrane segments of muscle nicotinic acetylcholine receptors
Nelli Mnatsakanyan et al.
JOURNAL OF NEUROCHEMISTRY (2013)
MMPBSA.py: An Efficient Program for End-State Free Energy Calculations
Bill R. Miller et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2012)
Gating Movement of Acetylcholine Receptor Caught by Plunge-Freezing
Nigel Unwin et al.
JOURNAL OF MOLECULAR BIOLOGY (2012)
OPM database and PPM web server: resources for positioning of proteins in membranes
Mikhail A. Lomize et al.
NUCLEIC ACIDS RESEARCH (2012)
Restoration of soman-blocked neuromuscular transmission in human and rat muscle by the bispyridinium non-oxime MB327 in vitro
T. Seeger et al.
TOXICOLOGY (2012)
Improved Treatment of Ligands and Coupling Effects in Empirical Calculation and Rationalization of pKa Values
Chresten R. Sondergaard et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2011)
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)
Protection against nerve agent poisoning by a noncompetitive nicotinic antagonist
S. R. Turner et al.
TOXICOLOGY LETTERS (2011)
Interaction of bispyridinium compounds with the orthosteric binding site of human α7 and Torpedo californica nicotinic acetylcholine receptors (nAChRs)
K. V. Niessen et al.
TOXICOLOGY LETTERS (2011)
Structural determinants for interaction of partial agonists with acetylcholine binding protein and neuronal α7 nicotinic acetylcholine receptor
Ryan E. Hibbs et al.
EMBO JOURNAL (2009)
PROMALS3D: a tool for multiple protein sequence and structure alignments
Jimin Pei et al.
NUCLEIC ACIDS RESEARCH (2008)
Reevaluation of indirect field stimulation technique to demonstrate oxime effectiveness in OP-poisoning in muscles in vitro
T. Seeger et al.
TOXICOLOGY (2007)
Statistical potential for assessment and prediction of protein structures
Min-Yi Shen et al.
PROTEIN SCIENCE (2006)
Counting out to the flexibility of molecules
W Whiteley
PHYSICAL BIOLOGY (2005)
The Amber biomolecular simulation programs
DA Case et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2005)
A novel positive allosteric modulator of the α7 neuronal nicotinic acetylcholine receptor:: In vitro and in vivo characterization
RS Hurst et al.
JOURNAL OF NEUROSCIENCE (2005)
Refined structure of the nicotinic acetylcholine receptor at 4 Å resolution
N Unwin
JOURNAL OF MOLECULAR BIOLOGY (2005)
Reactivation and aging kinetics of human acetylcholinesterase inhibited by organophosphonylcholines
F Worek et al.
ARCHIVES OF TOXICOLOGY (2004)
Nicotine and carbamylcholine binding to nicotinic acetylcholine receptors as studied in AChBP crystal structures
PHN Celie et al.
NEURON (2004)
UCSF chimera - A visualization system for exploratory research and analysis
EF Pettersen et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2004)
Exploring protein native states and large-scale conformational changes with a modified generalized born model
A Onufriev et al.
PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS (2004)
分享论文
