Recent Announcements

  • WEB Lab Computing Grid @Brooklyn College Check out this post in the research area regarding Brooklyn College's computing grid science project. 
    Posted Apr 18, 2015, 7:48 PM by Emilio Gallicchio
  • Paper on Host-Guest Binding Appears in the Journal of Computer Aided Molecular Design The paper reports the results of a classroom-based computational experiment to predict binding affinity experimental measurements for a novel octa-acid host.Emilio Gallicchio, Haoyuan Chen, He Chen, Michael ...
    Posted Mar 6, 2015, 7:21 AM by Emilio Gallicchio
  • Silvia De Rubeis Seminar on Autism Friday February 6th 2015, 2:30PM room 432NE, CUNY Brooklyn CollegeSilvia De RubeisIcahn School of Medicine at Mount Sinai"Unraveling the neurogenetics of autism spectrum disorder"De Rubeis ...
    Posted Feb 6, 2015, 9:43 AM by Emilio Gallicchio
  • Update on AGBNP2 speed optimization The work on improving performance of our AGBNP2 implementation is progressing. Check out this post for details.
    Posted Nov 28, 2014, 8:50 AM by Emilio Gallicchio
Showing posts 1 - 4 of 21. View more »

 Main Research Activities

  • Protein conformational equilibria
  • Thermodynamics of protein-protein and protein-ligand binding
  • Statistical thermodynamics of protein folding and misfolding
  • Thermodynamics of solvation of biological macromolecules
  • Force field development and high resolution protein modeling
  • Modeling of hydrophobic solvation
  • Design of high performance computational chemistry algorithms
  • Parallel and distributed computing

Support from the National Science Foundation is gratefully acknowledged