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Jean-François Truchon
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2010 – 2019
- 2014
- [j8]Jean-François Truchon, Kristina Grabowski, Barbara Sander, Alain Ajamian:
Exploiting solvent effects in drug design and optimization. J. Cheminformatics 6(S-1): 43 (2014) - 2010
- [j7]Alexandre Meunier, Jean-François Truchon:
Predictions of hydration free energies from continuum solvent with solute polarizable models: the SAMPL2 blind challenge. J. Comput. Aided Mol. Des. 24(4): 361-372 (2010) - [j6]Jean-François Truchon, Anthony Nicholls, J. Andrew Grant, Radu I. Iftimie, Benoît Roux, Christopher I. Bayly:
Using electronic polarization from the internal continuum (EPIC) for intermolecular interactions. J. Comput. Chem. 31(4): 811-824 (2010)
2000 – 2009
- 2007
- [j5]Jean-François Truchon, Christopher I. Bayly:
Evaluating Virtual Screening Methods: Good and Bad Metrics for the "Early Recognition" Problem. J. Chem. Inf. Model. 47(2): 488-508 (2007) - [j4]Georgia B. McGaughey, Robert P. Sheridan, Christopher I. Bayly, J. Christopher Culberson, Constantine Kreatsoulas
, Stacey Lindsley, Vladimir N. Maiorov, Jean-François Truchon, Wendy D. Cornell:
Comparison of Topological, Shape, and Docking Methods in Virtual Screening. J. Chem. Inf. Model. 47(4): 1504-1519 (2007) - 2006
- [j3]Jean-François Truchon, Christopher I. Bayly:
GLARE: A New Approach for Filtering Large Reagent Lists in Combinatorial Library Design Using Product Properties. J. Chem. Inf. Model. 46(4): 1536-1548 (2006) - 2004
- [j2]Nohad Gresh, Sherif A. Kafafi, Jean-François Truchon, Dennis R. Salahub:
Intramolecular interaction energies in model alanine and glycine tetrapeptides. Evaluation of anisotropy, polarization, and correlation effects. A parallel ab initio HF/MP2, DFT, and polarizable molecular mechanics study. J. Comput. Chem. 25(6): 823-834 (2004) - 2003
- [j1]Suzanne W. Sirois, Emil I. Proynov
A density functional study of the hydrogen-bond network within the HIV-1 protease catalytic site cleft. J. Comput. Chem. 24(9): 1110-1119 (2003)
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