May 2011

Xuhui, Lintai and Lu go to USTC(Hefei) for The 11th National Conference of Quantum Chemistry (NCQC)!

Mar 2011

Congs on Daniel for his work on simulating the ligand binding by the LAO protein has been accepted for publication in the PLoS Computational Biology ! The manuscript can be found here

Feb 2011

Congs on Raymond and Daniel for their work on simulating the T-jump triggered unfolding dynamics of Trpzip2 peptide has been accepted for publication in the Journal of Physical Chemistry B! This work is also the …

Jan 2011

Prof. Huang co-organizes the MULTI-SCALE MODELLING OF BIOSYSTEMS: FROM MOLECULAR TO MESOCALE session in Pacific symposium on Biocomputing 2011. See: Bernauer J, Flores S, Huang X, Zhou R, Shin S: . MULTI-SCALE MODELLING OF BIOSYSTEMS: …

Jan 2011

Our group has organized the Stanford-HKUST joint workshop on molecular dynamics simulation analysis with Markov State Models.

Dec 2010

Our Computational Chemistry and Biology (CCB) computer cluster is officially in production now! The cluster contains fifty 8-core servers (2XQuad-core Xeon E5620 2.4GHz) connected with DDR InfiniBand Switches.