2005 Annual Meeting

Session: Computational Biology: Part II

Co-Chair

Michael R. King, University of Rochester

Presentations

03:15 PM

(393a) Changes and Challenges: Gist, Mutated C-Kit and Imatinib Resistance
Sabrina Pricl, Marco Ferrone, Maria Silvia Paneni, Maurizio Fermeglia, Elena Tamborini, Silvana Pilotti, Marco A. Pierotti

03:33 PM

(393b) Where Are We in HIV Research? a Novel, Computer-Based Strategy for Predicting Resistance to HIV-1 Nnrtis
Marco Ferrone, Maria Silvia Paneni, Sabrina Pricl, Maurizio Fermeglia

03:51 PM

(393c) Computational Quantum Chemistry for Drug Screening Using the Conjugate Capping Method for Full Protein-Inhibitor Energy Prediction
Rishi R. Gupta, Luke E. Achenie

04:09 PM

(393d) Structure and Dynamics of Lipid Membranes: How Can Simulations Aid Experiments?
Jeffery B. Klauda, Bernard R. Brooks, Richard W. Pastor

04:27 PM

(393e) Influence of Anionic and Zwitterionic Membrane Interfaces on Structure of Antimicrobial Peptides and Implications on Peptide Toxicity and Activity: a Molecular Dynamics Simulation Investigation
Himanshu Khandelia, Yiannis Kaznessis

04:45 PM

(393f) Structural and Dynamic Properties of Mixed Bilayer Systems with Cryoprotectants
Amadeu K. Sum

05:03 PM

(393g) Prediction of Pka Shifts in Proteins Using a Discrete Rotamer Search and the Rosetta Energy Function
Jeffrey J. Gray, Ryan Marques Harrison

05:21 PM

(393h) A New Model for Simulation of Long DNA
Thomas A. Knotts, Nitin Rathore, Juan J. De Pablo