| Wednesday, 2 November 2005: 3:15 PM-5:45 PM | |||
| Bluegrass A (Hyatt Regency Cincinnati) | |||
Computational Molecular Science and Engineering Forum (21) | |||
| #393 - Computational Biology: Part II (21023) | |||
| tba | |||
| CoChair: | Michael R. King | ||
| Chair: | Vassily Hatzimanikatis | ||
| 3:15 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 | |
| 3:33 PM | 393b | Where Are We in HIV Research? a Novel, Computer-Based Strategy for Predicting Resistance to HIV-1 Nnrtis Sabrina Pricl, Marco Ferrone, Maria Silvia Paneni, Maurizio Fermeglia | |
| 3:51 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 | |
| 4:09 PM | 393d | Structure and Dynamics of Lipid Membranes: How Can Simulations Aid Experiments? Jeffery B. Klauda, Bernard R. Brooks, Richard W. Pastor | |
| 4:27 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 | |
| 4:45 PM | 393f | Structural and Dynamic Properties of Mixed Bilayer Systems with Cryoprotectants Amadeu K. Sum | |
| 5:03 PM | 393g | Prediction of Pka Shifts in Proteins Using a Discrete Rotamer Search and the Rosetta Energy Function Ryan Marques Harrison, Jeffrey J. Gray | |
| 5:21 PM | 393h | A New Model for Simulation of Long DNA Thomas A. Knotts, Nitin Rathore, Juan J. De Pablo | |
| Sponsor: | Computational Molecular Science and Engineering Forum | ||
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