School on Understanding Molecular Simulations

Posters List

Amit Kumar Bhattacharjee	Hydrodynamic Models of Intracellular Pattern Formation
Arvind Ananthanarayanan	Some Structural and Thermomechanical Properties of Lithium Aluminum Silicate Glass-ceramics
Bharat V. Adkar, Raghavan Varadarajan, Biman Bagchi	Binding enthalpy calculations of RNase-S protein-peptide complex using MD simulations
Dhiraj Kumar Mahajan	Multiscale Modeling of Deformation Behavior of Glassy Amorphous Polymers
Jayasree K	Stretching and condensation of polyelectrolytes
Kaliaperumal Selvaraj	Effect of Local Structure on Chemical Shielding of 29Si at Early Stages of Zeolite Synthesis - A DFT Based Computational Study
Mousumi Upadhyay Kahaly and Umesh Waghmare	Nanoscale vibrations and thermal properties of boron nitride nanotubes
Mrinal Kanti Bera	Buckling of monolayer of Gold Nanoparticles on Air-Water interface
Poonam Singhal and B. Jayaram	Molecular Dynamics Based Physicochemical Model for Genome Analysis
Ruchi Sharma	Entropy, Diffusivity and Structural Order in Liquids with Water-like Anomalies
Shahab Zorriasatein, Kavita Joshi, and D. G. Kanhere	Dopant induced stabilization of Silicon cluster at ﬁnite temperature
Sneha Elizabeth Abraham
Sudipta Samanta	Role of Base Pairs in Molecular Recognition in a Protein/DNA Complex?
Debashree Chakrabarty	Voids in supercritical fluids and its effect on solute diffusion
Rini Gupta and Amalendu Chandra	Single particle and pair dynamics in water-acetone mixtures containing ionic and neutral solutes:Diffusion, orientational relaxation and hydrogen bond dynamics
Ashok Kumar Das Mahapatra, Guruswamy Kumaraswamy and Hemant Nanavati	Dynamic Monte Carlo Simulation of Heteropolymer Collapse