Impact of the Chirality and Curvature of Carbon Nanostructures on Their Interaction with Aromatics and Amino Acids

Understanding Substituent Effects in Noncovalent Interactions Involving Aromatic Rings

(2012) Steven E. Wheeler   ACCOUNTS OF CHEMICAL RESEARCH

Metal ion binding with carbon nanotubes and graphene: Effect of chirality and curvature

(2012) Deivasigamani Umadevi et al.   CHEMICAL PHYSICS LETTERS

Functionalization of Graphene: Covalent and Non-Covalent Approaches, Derivatives and Applications

(2012) Vasilios Georgakilas et al.   CHEMICAL REVIEWS

Cation−π Interaction: Its Role and Relevance in Chemistry, Biology, and Material Science

(2012) A. Subha Mahadevi et al.   CHEMICAL REVIEWS

The significance of the alkene size and the nature of the metal ion in metal–alkene complexes: a theoretical study

(2012) J. Richard Premkumar et al.   DALTON TRANSACTIONS

Simulating Adsorption of Organic Pollutants on Finite (8,0) Single-Walled Carbon Nanotubes in Water

(2012) Mingying Zou et al.   ENVIRONMENTAL SCIENCE & TECHNOLOGY

Unzipping and binding of small interfering RNA with single walled carbon nanotube: A platform for small interfering RNA delivery

(2012) Mogurampelly Santosh et al.   JOURNAL OF CHEMICAL PHYSICS

Amino acid analogues bind to carbon nanotube via π-π interactions: Comparison of molecular mechanical and quantum mechanical calculations

(2012) Zaixing Yang et al.   JOURNAL OF CHEMICAL PHYSICS

Buckyplates and Buckybowls: Examining the Effects of Curvature on π–π Interactions

(2012) Matthew R. Kennedy et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Interaction of Nucleobases with Wrinkled Graphene Surface: Dispersion Corrected DFT and AFM Studies

(2012) Swati Panigrahi et al.   Journal of Physical Chemistry C

Predictions of Gibbs Free Energies for the Adsorption of Polyaromatic and Nitroaromatic Environmental Contaminants on Carbonaceous Materials: Efficient Computational Approach

(2012) A. M. Scott et al.   LANGMUIR

Contrasting preferences of N and P substituted heteroaromatics towards metal binding: probing the regioselectivity of Li+ and Mg2+ binding to (CH)6−m−nNmPn

(2012) Bhaskar Sharma et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Where to bind in buckybowls? The dilemma of a metal ion

(2012) Dolly Vijay et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Aromatic Rings in Chemical and Biological Recognition: Energetics and Structures

(2011) Laura M. Salonen et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Aromatic–Aromatic Interactions Database, A2ID: An analysis of aromatic π-networks in proteins

(2011) Mukesh Chourasia et al.   INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES

Effect of Curvature on the α-Helix Breaking Tendency of Carbon Based Nanomaterials

(2011) K. Balamurugan et al.   Journal of Physical Chemistry C

Adsorption of Villin Headpiece onto Graphene, Carbon Nanotube, and C60: Effect of Contacting Surface Curvatures on Binding Affinity

(2011) Guanghong Zuo et al.   Journal of Physical Chemistry C

Molecular and Ionic Interaction with Graphene Nanoflakes: A Computational Investigation of CO2, H2O, Li, Mg, Li+, and Mg2+ Interaction with Polycyclic Aromatic Hydrocarbons

(2011) Deivasigamani Umadevi et al.   Journal of Physical Chemistry C

Interaction of Amino Acids and Single-Wall Carbon Nanotubes

(2011) Lingyu Piao et al.   Journal of Physical Chemistry C

Quantum Mechanical Study of Physisorption of Nucleobases on Carbon Materials: Graphene versus Carbon Nanotubes

(2011) Deivasigamani Umadevi et al.   Journal of Physical Chemistry Letters

Carbon materials for drug delivery & cancer therapy

(2011) Zhuang Liu et al.   Materials Today

Adsorption and properties of aromatic amino acids on single-walled carbon nanotubes

(2011) Cuihong Wang et al.   Nanoscale

Binding of blood proteins to carbon nanotubes reduces cytotoxicity

(2011) C. Ge et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Ab initio investigation of benzene clusters: Molecular tailoring approach

(2010) A. Subha Mahadevi et al.   JOURNAL OF CHEMICAL PHYSICS

Exploring the Changes in the Structure of α-Helical Peptides Adsorbed onto a Single Walled Carbon Nanotube Using Classical Molecular Dynamics Simulation

(2010) K. Balamurugan et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Nano meets bio at the interface

(2010) Jerzy Leszczynski   Nature Nanotechnology

Adsorption of nitro-substituted aromatics on single-walled carbon nanotubes

(2010) E. S. Alldredge et al.   PHYSICAL REVIEW B

Remarkable diversity of carbon–carbon bonds: structures and properties of fullerenes, carbon nanotubes, and graphene

(2010) T. C. Dinadayalane et al.   STRUCTURAL CHEMISTRY

Biomimetic Chemosensor: Designing Peptide Recognition Elements for Surface Functionalization of Carbon Nanotube Field Effect Transistors

(2009) Zhifeng Kuang et al.   ACS Nano

Graphene: The New Two-Dimensional Nanomaterial

(2009) C. N. R. Rao et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

The cooperativity of cation–π and π–π interactions

(2009) Dolly Vijay et al.   CHEMICAL PHYSICS LETTERS

A theoretical study on the interaction of aromatic amino acids with graphene and single walled carbon nanotube

(2009) Chinagandham Rajesh et al.   JOURNAL OF CHEMICAL PHYSICS

Noncovalent π−π Stacking and CH---π Interactions of Aromatics on the Surface of Single-Wall Carbon Nanotubes: An MP2 Study

(2009) Tapas Kar et al.   Journal of Physical Chemistry C

Noncovalent Modification of Carbon Nanotubes with Ferrocene−Amino Acid Conjugates for Electrochemical Sensing of Chemical Warfare Agent Mimics

(2008) Mohammad A. K. Khan et al.   ANALYTICAL CHEMISTRY

Do Special Noncovalent π–π Stacking Interactions Really Exist?

(2008) Stefan Grimme   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Binding of nucleobases with single-walled carbon nanotubes: Theory and experiment

(2008) Anindya Das et al.   CHEMICAL PHYSICS LETTERS

Binding of DNA Nucleobases and Nucleosides with Graphene

(2008) Neenu Varghese et al.   CHEMPHYSCHEM

Nanoscale Curvature-Induced Hydrogen Adsorption in Alkali Metal Doped Carbon Nanomaterials

(2008) K. R. S. Chandrakumar et al.   Journal of Physical Chemistry C

PEGylated Nanographene Oxide for Delivery of Water-Insoluble Cancer Drugs

(2008) Zhuang Liu et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Exploring the size dependence of cyclic and acyclic π-systems on cation–π binding

(2008) Dolly Vijay et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Nanoparticle size and surface properties determine the protein corona with possible implications for biological impacts

(2008) M. Lundqvist et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA