4.7 Article

PSNtools for standalone and web-based structure network analyses of conformational ensembles

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 Biochemistry & Molecular Biology

Structure network-based landscape of rhodopsin misfolding by mutations and algorithmic prediction of small chaperone action

Angelo Felline et al.

Summary: This study employed a computational model to predict the endoplasmic reticulum retention of RP mutants and determine the structural determinants of small chaperone action on misfolded protein mutants with therapeutic implications. The approach is applicable to conformational diseases linked to missense mutations in any membrane protein.

COMPUTATIONAL AND STRUCTURAL BIOTECHNOLOGY JOURNAL (2021)

Article Biochemistry & Molecular Biology

webPSN v2.0: a webserver to infer fingerprints of structural communication in biomacromolecules

Angelo Felline et al.

NUCLEIC ACIDS RESEARCH (2020)

Article Biochemistry & Molecular Biology

Dynamics and structural communication in the ternary complex of fully phosphorylated V2 vasopressin receptor, vasopressin, and β-arrestin 1

Luca Bellucci et al.

BIOCHIMICA ET BIOPHYSICA ACTA-BIOMEMBRANES (2020)

Article Biochemistry & Molecular Biology

NAPS update: network analysis of molecular dynamics data and protein-nucleic acid complexes

Broto Chakrabarty et al.

NUCLEIC ACIDS RESEARCH (2019)

Article Chemistry, Medicinal

Interconnecting Flexibility, Structural Communication, and Function in RhoGEF Oncoproteins

Angelo Felline et al.

JOURNAL OF CHEMICAL INFORMATION AND MODELING (2019)

Article Chemistry, Physical

Protein Residue Networks from Energetic and Geometric Data: Are They Identical?

Vladimir Sladek et al.

JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2018)

Article Chemistry, Physical

Structural Determinants of Constitutive Activation of Gα Proteins: Transducin as a Paradigm

Angelo Feline et al.

JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2017)

Article Multidisciplinary Sciences

An optimal distance cutoff for contact- based Protein Structure Networks using side- chain centers of mass

Juan Salamanca Viloria et al.

SCIENTIFIC REPORTS (2017)

Article Biochemical Research Methods

MD-TASK: a software suite for analyzing molecular dynamics trajectories

David K. Brown et al.

BIOINFORMATICS (2017)

Review Biochemistry & Molecular Biology

Protein Structure and Function: Looking through the Network of Side-Chain Interactions

Moitrayee Bhattacharyya et al.

CURRENT PROTEIN & PEPTIDE SCIENCE (2016)

Article Biophysics

MDN: A Web Portal for Network Analysis of Molecular Dynamics Simulations

Andre A. S. T. Ribeiro et al.

BIOPHYSICAL JOURNAL (2015)

Article Chemistry, Medicinal

Catching Functional Modes and Structural Communication in Dbl Family Rho Guanine Nucleotide Exchange Factors

Francesco Raimondi et al.

JOURNAL OF CHEMICAL INFORMATION AND MODELING (2015)

Article Biochemical Research Methods

WebPSN: a web server for high-throughput investigation of structural communication in biomacromolecules

Michele Seeber et al.

BIOINFORMATICS (2015)

Article Chemistry, Medicinal

PyInteraph: A Framework for the Analysis of Interaction Networks in Structural Ensembles of Proteins

Matteo Tiberti et al.

JOURNAL OF CHEMICAL INFORMATION AND MODELING (2014)

Article Biochemistry & Molecular Biology

Light on the structural communication in Ras GTPases

Francesco Raimondi et al.

JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS (2013)

Review Multidisciplinary Sciences

Molecular signatures of G-protein-coupled receptors

A. J. Venkatakrishnan et al.

NATURE (2013)

Article Biochemistry & Molecular Biology

An automated approach to network features of protein structure ensembles

Moitrayee Bhattacharyya et al.

PROTEIN SCIENCE (2013)

Article Biochemical Research Methods

Network and Atomistic Simulations Unveil the Structural Determinants of Mutations Linked to Retinal Diseases

Simona Mariani et al.

PLOS COMPUTATIONAL BIOLOGY (2013)

Article Biochemical Research Methods

A Mechanistic Understanding of Allosteric Immune Escape Pathways in the HIV-1 Envelope Glycoprotein

Anurag Sethi et al.

PLOS COMPUTATIONAL BIOLOGY (2013)

Article Biochemistry & Molecular Biology

Detection of allosteric signal transmission by information-theoretic analysis of protein dynamics

Alessandro Pandini et al.

FASEB JOURNAL (2012)

Article Biochemistry & Molecular Biology

Allosteric Communication between the Pyridoxal 5′-Phosphate (PLP) and Heme Sites in the H2S Generator Human Cystathionine β-Synthase

Pramod Kumar Yadav et al.

JOURNAL OF BIOLOGICAL CHEMISTRY (2012)

Article Chemistry, Medicinal

xPyder: A PyMOL Plugin To Analyze Coupled Residues and Their Networks in Protein Structures

Marco Pasi et al.

JOURNAL OF CHEMICAL INFORMATION AND MODELING (2012)

Article Chemistry, Physical

Paths of long-range communication in the E2 enzymes of family 3: a molecular dynamics investigation

Elena Papaleo et al.

PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2012)

Article Biochemistry & Molecular Biology

Conserved amino acids participate in the structure networks deputed to intramolecular communication in the lutropin receptor

Krassimira Angelova et al.

CELLULAR AND MOLECULAR LIFE SCIENCES (2011)

Article Chemistry, Multidisciplinary

Wordom: A User-Friendly Program for the Analysis of Molecular Structures, Trajectories, and Free Energy Surfaces

Michele Seeber et al.

JOURNAL OF COMPUTATIONAL CHEMISTRY (2011)

Article Biochemistry & Molecular Biology

ASD: a comprehensive database of allosteric proteins and modulators

Zhimin Huang et al.

NUCLEIC ACIDS RESEARCH (2011)

Article Biochemistry & Molecular Biology

Analyzing and visualizing residue networks of protein structures

Nadezhda T. Doncheva et al.

TRENDS IN BIOCHEMICAL SCIENCES (2011)

Article Biophysics

Interaction Energy Based Protein Structure Networks

M. S. Vijayabaskar et al.

BIOPHYSICAL JOURNAL (2010)

Article Biochemistry & Molecular Biology

Structural insights into retinitis pigmentosa from unfolding simulations of rhodopsin mutants

Francesca Fanelli et al.

FASEB JOURNAL (2010)

Article Biochemistry & Molecular Biology

Identification of an Allosteric Signaling Network within Tec Family Kinases

Raji E. Joseph et al.

JOURNAL OF MOLECULAR BIOLOGY (2010)

Article Biochemistry & Molecular Biology

Allostery and conformational free energy changes in human tryptophanyl-tRNA synthetase from essential dynamics and structure networks

Moitrayee Bhattacharyya et al.

PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS (2010)

Review Biochemistry & Molecular Biology

Intra and Inter-Molecular Communications Through Protein Structure Network

Saraswathi Vishveshwara et al.

CURRENT PROTEIN & PEPTIDE SCIENCE (2009)

Article Multidisciplinary Sciences

Hidden dynamic allostery in a PDZ domain

Chad M. Petit et al.

PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2009)

Article Multidisciplinary Sciences

Dynamical networks in tRNA: protein complexes

Anurag Sethi et al.

PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2009)

Article Biochemistry & Molecular Biology

Coupling between global dynamics and signal transduction pathways: a mechanism of allostery for chaperonin GroEL

Chakra Chennubhotla et al.

MOLECULAR BIOSYSTEMS (2008)

Article Health Care Sciences & Services

Revisiting youden's index as a useful measure of the misclassification error in meta-analysis of diagnostic studies

Dankmar Bohning et al.

STATISTICAL METHODS IN MEDICAL RESEARCH (2008)

Article Multidisciplinary Sciences

A study of communication pathways in methionyl-tRNA synthetase by molecular dynamics simulations and structure network analysis

Amit Ghosh et al.

PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2007)

Article Biochemical Research Methods

Signal propagation in proteins and relation to equilibrium fluctuations

Chakra Chennubhotla et al.

PLOS COMPUTATIONAL BIOLOGY (2007)

Review Biochemistry & Molecular Biology

Network analysis of protein dynamics

Csaba Boede et al.

FEBS LETTERS (2007)

Article Biochemical Research Methods

Biological network comparison using graphlet degree distribution

Natasa Przulj

BIOINFORMATICS (2007)

Article Biochemistry & Molecular Biology

Generalized correlation for biomolecular dynamics

OF Lange et al.

PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS (2006)

Article Chemistry, Medicinal

Vitamin D receptor: Ligand recognition and allosteric network

K Yamamoto et al.

JOURNAL OF MEDICINAL CHEMISTRY (2006)

Article Health Care Sciences & Services

A solution for the most basic optimization problem associated with an ROC curve

Chap T. Le

STATISTICAL METHODS IN MEDICAL RESEARCH (2006)

Article Biochemistry & Molecular Biology

Structural determinants of allosteric ligand activation in RXR heterodimers

AI Shulman et al.

Article Biochemistry & Molecular Biology

Network analysis of protein structures identifies functional residues

G Amitai et al.

JOURNAL OF MOLECULAR BIOLOGY (2004)

Article Multidisciplinary Sciences

Crystal structures of the vitamin D receptor complexed to superagonist 20-epi ligands

G Tocchini-Valentini et al.

PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2001)

Review Neurosciences

PDZ domains and the organization of supramolecular complexes

M Sheng et al.

ANNUAL REVIEW OF NEUROSCIENCE (2001)