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。Protein stability at a carbon nanotube interface
S. Vaitheeswaran et al.
JOURNAL OF CHEMICAL PHYSICS (2011)
Urea-Induced Drying of Hydrophobic Nanotubes: Comparison of Different Urea Models
Peng Xiu et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2011)
Carbon Nanotube Wins the Competitive Binding over Proline-Rich Motif Ligand on SH3 Domain
Guanghong Zuo et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2011)
Face-to-Face Arene-Arene Binding Energies: Dominated by Dispersion but Predicted by Electrostatic and Dispersion/Polarizability Substituent Constants
Michelle Watt et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2011)
Ab initio theoretical study of non-covalent adsorption of aromatic molecules on boron nitride nanotubes
Yu Zhao et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2011)
Binding of blood proteins to carbon nanotubes reduces cytotoxicity
Cuicui Ge et al.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2011)
Fya/Fyb antigen polymorphism in human erythrocyte Duffy antigen affects susceptibility to Plasmodium vivax malaria
Christopher L. King et al.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2011)
Computational Design of Virus-Like Protein Assemblies on Carbon Nanotube Surfaces
Gevorg Grigoryan et al.
SCIENCE (2011)
Molecular Dynamics Study of a Carbon Nanotube Binding Reversible Cyclic Peptide
Chi-cheng Chiu et al.
ACS NANO (2010)
Plugging into Proteins: Poisoning Protein Function by a Hydrophobic Nanoparticle
Guanghong Zuo et al.
ACS NANO (2010)
Structure-based design of carbon nanotubes as HIV-1 protease inhibitors: Atomistic and coarse-grained simulations
Yuan Cheng et al.
JOURNAL OF MOLECULAR GRAPHICS & MODELLING (2010)
Diameter Selectivity of Protein Encapsulation in Carbon Nanotubes
Yu Kang et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2010)
Exploring the Changes in the Structure of α-Helical Peptides Adsorbed onto a Single Walled Carbon Nanotube Using Classical Molecular Dynamics Simulation
K. Balamurugan et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2010)
Isolation of Individual Boron Nitride Nanotubes via Peptide Wrapping
Zhenghong Gao et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2010)
Formulation and evaluation of novel micellar nanocarrier for nasal delivery of sumatriptan
Ratnesh Jain et al.
NANOMEDICINE (2010)
A multiscale simulation study of carbon nanotube interactions with designed amphiphilic peptide helices
E. Jayne Wallace et al.
NANOSCALE (2010)
Carbon nanotubes degraded by neutrophil myeloperoxidase induce less pulmonary inflammation
Valerian E. Kagan et al.
NATURE NANOTECHNOLOGY (2010)
Targeted Killing of Cancer Cells in Vivo and in Vitro with EGF-Directed Carbon Nanotube-Based Drug Delivery
Ashwin A. Bhirde et al.
ACS NANO (2009)
Bio-nano interaction of proteins adsorbed on single-walled carbon nanotubes
Jun Zhong et al.
CARBON (2009)
An optimized replica exchange molecular dynamics method
Hiqmet Kamberaj et al.
JOURNAL OF CHEMICAL PHYSICS (2009)
Quantum Mechanical Quantification of Weakly Interacting Complexes of Peptides with Single-Walled Carbon Nanotubes
Wenjie Fan et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2009)
Computational Study of a Nanobiosensor: A Single-Walled Carbon Nanotube Functionalized with the Coxsackie-Adenovirus Receptor
Robert R. Johnson et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2009)
Atomic-Scale Modeling of the Interaction between Short Polypeptides and Carbon Surfaces
Giulio Gianese et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2009)
Modeling the Binding Affinity of Peptides for Graphitic Surfaces. Influences of Aromatic Content and Interfacial Shape
Susana M. Tomasio et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2009)
Manipulating Biomolecules with Aqueous Liquids Confined within Single-Walled Nanotubes
Peng Xiu et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2009)
Free Energy Landscape of a DNA-Carbon Nanotube Hybrid Using Replica Exchange Molecular Dynamics
Robert. R. Johnson et al.
NANO LETTERS (2009)
Induced stepwise conformational change of human serum albumin on carbon nanotube surfaces
Jia-Wei Shen et al.
BIOMATERIALS (2008)
SWNT-amino acid interactions: A theoretical study
Aned de Leon et al.
CHEMICAL PHYSICS LETTERS (2008)
Zigzag SWNT-amino acid interactions: Theoretical insights
Aned De Leon et al.
COMPUTATIONAL MATERIALS SCIENCE (2008)
Benzene Dimer: High-Level Wave Function and Density Functional Theory Calculations
M. Pitonak et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2008)
GROMACS 4: Algorithms for highly efficient, load-balanced, and scalable molecular simulation
Berk Hess et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2008)
Ranking the affinity of aromatic residues for carbon nanotubes by using designed surfactant peptides
Hui Xie et al.
JOURNAL OF PEPTIDE SCIENCE (2008)
Molecular Dynamics Study of a Nanotube-Binding Amphiphilic Helical Peptide at Different Water/Hydrophobic Interfaces
Chi-cheng Chiu et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2008)
A prototype for graphene material simulation: Structures and interaction potentials of coronene dimers
Yan Zhao et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2008)
Nanotoxicology: Are carbon nanotubes safe?
Yuliang Zhao et al.
NATURE NANOTECHNOLOGY (2008)
The interaction of carbohydrates and amino acids with aromatic systems studied by density functional and semi-empirical molecular orbital calculations with dispersion corrections
Raman Sharma et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2008)
Random walk in orthogonal space to achieve efficient free-energy simulation of complex systems
Lianqing Zheng et al.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2008)
Single-walled carbon nanotube binding peptides: Probing tryptophan's importance by unnatural amino acid substitution
Zhengding Su et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2007)
Interaction of tyrosine-, tryptophan-, and lysine-containing polypeptides with single-wall carbon nanotubes and its relevance for the rational design of dispersing agents
Christoph G. Salzmann et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2007)
Exploring a nanotube dispersion mechanism with gold-labeled proteins via Cryo-TEM imaging
Pola Goldberg-Oppenheimer et al.
SMALL (2007)
High accuracy benchmark calculations on the benzene dimer potential energy surface
Tomasz Janowski et al.
CHEMICAL PHYSICS LETTERS (2007)
DFTB+, a sparse matrix-based implementation of the DFTB method
B. Aradi et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2007)
Proteins and carbon nanotubes: Close encounter in water
Dhriti Nepal et al.
SMALL (2007)
Understanding of assembly phenomena by aromatic-aromatic interactions: Benzene dimer and the substituted systems
Eun Cheol Lee et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2007)
Adsorption of simple benzene derivatives on carbon nanotubes
L. M. Woods et al.
PHYSICAL REVIEW B (2007)
Atomistic modelling of the interaction between peptides and carbon nanotubes
S. De Miranda Tomasio et al.
MOLECULAR PHYSICS (2007)
High-accuracy quantum mechanical studies of π-π interactions in benzene dimers
Mutasem Omar Sinnokrot et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2006)
Direct measurements of interactions between polypeptides and carbon nanotubes
Xiaojun Li et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2006)
Selective interaction of large or charge-transfer aromatic molecules with metallic single-wall carbon nanotubes: Critical role of the molecular size and orientation
J Lu et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2006)
pH-sensitive dispersion and debundling of single-walled carbon nanotubes: Lysozyme as a tool
D Nepal et al.
SMALL (2006)
Benchmark database of accurate (MP2 and CCSD(T) complete basis set limit) interaction energies of small model complexes, DNA base pairs, and amino acid pairs
P Jurecka et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2006)
CH/π interactions involving aromatic amino acids:: Refinement of the CHARMM tryptophan force field
AT Macias et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2005)
Importance of aromatic content for peptide/single-walled carbon nanotube interactions
V Zorbas et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2005)
An efficient a Posteriori treatment for dispersion interaction in density-functional-based tight binding
L Zhechkov et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2005)
Ab initio study of benzene adsorption on carbon nanotubes -: art. no. 165421
F Tournus et al.
PHYSICAL REVIEW B (2005)
Observation of a dewetting transition in the collapse of the melittin tetramer
P Liu et al.
NATURE (2005)
Hydrophobic collapse in multidomain protein folding
RH Zhou et al.
SCIENCE (2004)
Accurate description of van der Waals complexes by density functional theory including empirical corrections
S Grimme
JOURNAL OF COMPUTATIONAL CHEMISTRY (2004)
Extending the treatment of backbone energetics in protein force fields: Limitations of gas-phase quantum mechanics in reproducing protein conformational distributions in molecular dynamics simulations
AD Mackerell et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2004)
Structure and function of enzymes adsorbed onto single-walled carbon nanotubes
SS Karajanagi et al.
LANGMUIR (2004)
Highly accurate coupled cluster potential energy curves for the benzene dimer: Sandwich, T-shaped, and parallel-displaced configurations
MO Sinnokrot et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2004)
Noncovalent functionalization of carbon nanotubes by aromatic organic molecules
JJ Zhao et al.
APPLIED PHYSICS LETTERS (2003)
Noncovalent functionalization of carbon nanotubes for highly specific electronic biosensors
RJ Chen et al.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2003)
Peptides with selective affinity for carbon nanotubes
SQ Wang et al.
NATURE MATERIALS (2003)
Controlled assembly of carbon nanotubes by designed amphiphilic peptide helices
GR Dieckmann et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2003)
Origin of attraction and directionality of the x/x interaction:: Model chemistry calculations of benzene dimer interaction
S Tsuzuki et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2002)
Water conduction through the hydrophobic channel of a carbon nanotube
G Hummer et al.
NATURE (2001)
Hydrogen bonding and stacking interactions of nucleic acid base pairs: A density-functional-theory based treatment
M Elstner et al.
JOURNAL OF CHEMICAL PHYSICS (2001)
分享论文
