Computational Modelling Group

Past Events related to Molecular Mechanics

Below are the events that have been offered though the CMG in the past.

September 2017

14th September 12:00 a.m.

The MMM Hub: Accelerating Materials and Molecular Modelling

November 2014

25th November 12:00 a.m.

Recent advances in the tribology and bioengineering of the skin

June 2014

4th June 2:00 p.m.

High Biomechanics of the neuromusculoskeletal system

March 2013

8th March 4:00 p.m.

The End of Atomistic Simulation?

September 2012

4th September 2:00 p.m.

Into the Looking Glass and What the Quantum Chemist Found There

August 2012

10th August 2:00 p.m.

Molecular simulation approaches to immunological recognition and regulation

June 2012

1st June 4:00 p.m.

Simulations of conformational dynamics along the p53-mdm2 pathway

May 2012

11th May 4:00 p.m.

Defining Hydrogen Bonds to Determine the Structure and Dynamics of Water

April 2012

27th April 2:00 p.m.

Computational challenges in wavefunction-based electronic structure theory
13th April 4:00 p.m.

First-principles vibrational spectroscopy and lattice dynamics of materials in the solid state

March 2012

23rd March 4:00 p.m.

The Effect of Charge on Boundary Layer Lubrication

December 2011

13th December 2:00 p.m.

Analyzing biomacromolecular flexibility by constraint counting

November 2011

30th November 1:00 p.m.

Overcoming frustration with local elevation: enhancing the sampling in biomolecular simulations biased with experimental data
22nd November 10:00 a.m.

Modelling the Solid State: From oxygen storage capacity to transparent semiconductors

September 2011

23rd September 2:00 p.m.

New Developments in Semiempirical MO Theory for Drug and Materials Design. (MGMS Lecture Tour Seminar)
16th September 2:00 p.m.

Molecular simulations of proteins undergoing fibrillation in neurodegenerative diseases

May 2011

13th May 3:30 p.m.

Molecular modeling - now fun and colorful!

April 2011

8th April 3:30 p.m.

Modulation of crystal nucleation: Insights from molecular simulation

March 2011

22nd March 4:00 p.m.

Computational biochemistry: understanding biomolecular mechanisms by modelling
7th March 2:00 p.m.

Free energy surfaces of proteins: folding, dynamics and mechanics

2nd March 2:00 p.m.

Computational Coordination Chemistry