List of works - Karteek K Bejagam

Autoresolution of Segregated and Mixed p-n Stacks by Stereoselective Supramolecular Polymerization in Solution.

scientific article published on 2 September 2015

Biomimetic temporal self-assembly via fuel-driven controlled supramolecular polymerization.

scientific article published on 30 March 2018

Development of New Transferable Coarse-Grained Models of Hydrocarbons

scientific article published on 06 July 2018

Development of Transferable Nonbonded Interactions between Coarse-Grained Hydrocarbon and Water Models

scientific article published on 16 January 2019

Development of non-bonded interaction parameters between graphene and water using particle swarm optimization

scientific article published on 19 December 2017

Dipole-moment-driven cooperative supramolecular polymerization

scientific article published on 16 March 2015

Dissolution of cellulose in room temperature ionic liquids: anion dependence.

scientific article published on 8 January 2015

External electric field reverses helical handedness of a supramolecular columnar stack

scientific article published on 01 November 2015

Host-Guest [2+2] Cycloaddition Reaction: Postsynthetic Modulation of CO2 Selectivity and Magnetic Properties in a Bimodal Metal-Organic Framework

scientific article published on 26 April 2016

Machine-Learned Coarse-Grained Models

scientific article published on 03 August 2018

Machine-Learning Based Stacked Ensemble Model for Accurate Analysis of Molecular Dynamics Simulations

scientific article published on 11 June 2019

Machine-Learning Enabled New Insights into the Coil-to-Globule Transition of Thermosensitive Polymers Using a Coarse-Grained Model

scientific article published on 02 November 2018

Molecular dynamics simulations for glass transition temperature predictions of polyhydroxyalkanoate biopolymers

scientific article published on 10 August 2020

PSO-Assisted Development of New Transferable Coarse-Grained Water Models.

scientific article published on 22 January 2018

Solvent Clathrate Driven Dynamic Stereomutation of a Supramolecular Polymer with Molecular Pockets

scientific article

Supramolecular Polymerization of N,N',N″,N‴-tetra-(Tetradecyl)-1,3,6,8-pyrenetetracarboxamide: A Computational Study.

scientific article published on 29 November 2017

Supramolecular polymerization of benzene-1,3,5-tricarboxamide: a molecular dynamics simulation study

scientific article published on 06 May 2014

Supramolecular polymerization: a coarse grained molecular dynamics study.