242nd ACS National Meeting, Denver, CO - COMP - Sessions

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Title Type Description Symposium Organizers Cosponsors
Battery Science and Computational ChemistryOral William Swope, swope@almaden.ibm.com
Battery Science and Computational ChemistryOral William Swope, swope@almaden.ibm.com
Battery Science and Computational ChemistryOral William Swope, swope@almaden.ibm.com
Battery Science and Computational ChemistryOralWilliam Swope, swope@almaden.ibm.com
BioinformaticsOralMelissa Landon, lissland@gmail.comBIOL
CINF
MEDI
Challenges in Industrial Computational MethodsOralCynthia Bancale, cynthia@eyesopen.comCINF
Challenges in Industrial Computational MethodsOral Cynthia Bancale, cynthia@eyesopen.comCINF
Challenges in Industrial Computational MethodsOral Cynthia Bancale, cynthia@eyesopen.comCINF
Challenges in Industrial Computational MethodsOral Cynthia Bancale, cynthia@eyesopen.comCINF
Chemical Computing Group Excellence AwardPosterCarlos Simmerling, carlos.simmerling@stonybrook.edu
Cheminformatics Aspects of High Throughput Screening: From Robots to ModelsOral Y. Jane Tseng, yjtseng@csie.ntu.edu.twCINF
MEDI
Cheminformatics Aspects of High Throughput Screening: From Robots to ModelsOral Y. Jane Tseng, yjtseng@csie.ntu.edu.twCINF
MEDI
Computational Approaches to Spectroscopy AnalysisOral Emilio Xavier Esposito, emilio.esposito@gmail.comANYL
CINF
PHYS
Computational Modeling of Photo-catalysis and Photo-induced Charge Transfer Dynamics on SurfacesOralDmitri Kilin, Dmitri.Kilin@usd.edu
Ivan Mikhaylov, ivan.mikhaylov@gmail.com
Svetlana Kilina, skilina@u.washington.edu
Computational Modeling of Photo-catalysis and Photo-induced Charge Transfer Dynamics on SurfacesOral Dmitri Kilin, Dmitri.Kilin@usd.edu
Svetlana Kilina, skilina@u.washington.edu
Ivan Mikhaylov, ivan.mikhaylov@gmail.com
Computational Modeling of Photo-catalysis and Photo-induced Charge Transfer Dynamics on SurfacesOral Dmitri Kilin, Dmitri.Kilin@usd.edu
Svetlana Kilina, skilina@u.washington.edu
Ivan Mikhaylov, ivan.mikhaylov@gmail.com
Computational Modeling of Photo-catalysis and Photo-induced Charge Transfer Dynamics on SurfacesOral Dmitri Kilin, Dmitri.Kilin@usd.edu
Ivan Mikhaylov, ivan.mikhaylov@gmail.com
Svetlana Kilina, skilina@u.washington.edu
Computational Modeling of Photo-catalysis and Photo-induced Charge Transfer Dynamics on SurfacesOral Dmitri Kilin, Dmitri.Kilin@usd.edu
Svetlana Kilina, skilina@u.washington.edu
Ivan Mikhaylov, ivan.mikhaylov@gmail.com
Computational Modeling of Photo-catalysis and Photo-induced Charge Transfer Dynamics on SurfacesOral Dmitri Kilin, Dmitri.Kilin@usd.edu
Ivan Mikhaylov, ivan.mikhaylov@gmail.com
Svetlana Kilina, skilina@u.washington.edu
Computational Modeling of Photo-catalysis and Photo-induced Charge Transfer Dynamics on SurfacesOral Dmitri Kilin, Dmitri.Kilin@usd.edu
Svetlana Kilina, skilina@u.washington.edu
Ivan Mikhaylov, ivan.mikhaylov@gmail.com
Computational Modeling of Photo-catalysis and Photo-induced Charge Transfer Dynamics on SurfacesOral Dmitri Kilin, Dmitri.Kilin@usd.edu
Ivan Mikhaylov, ivan.mikhaylov@gmail.com
Svetlana Kilina, skilina@u.washington.edu
Computational Modeling of Photo-catalysis and Photo-induced Charge Transfer Dynamics on SurfacesOral Dmitri Kilin, Dmitri.Kilin@usd.edu
Ivan Mikhaylov, ivan.mikhaylov@gmail.com
Svetlana Kilina, skilina@u.washington.edu
Computational Modeling of Photo-catalysis and Photo-induced Charge Transfer Dynamics on SurfacesOral Dmitri Kilin, Dmitri.Kilin@usd.edu
Ivan Mikhaylov, ivan.mikhaylov@gmail.com
Svetlana Kilina, skilina@u.washington.edu
Computational Study of WaterOral Emilio Xavier Esposito, emilio.esposito@gmail.com
Computational Study of WaterOral Emilio Xavier Esposito, emilio.esposito@gmail.com
Computational Study of WaterOralEmilio Xavier Esposito, emilio.esposito@gmail.com
Drug DiscoveryOralScott Wildman, wildman@biochem.wustl.edu
Y. Jane Tseng, yjtseng@csie.ntu.edu.tw
Drug DiscoveryOralY. Jane Tseng, yjtseng@csie.ntu.edu.tw
Scott Wildman, wildman@biochem.wustl.edu
Drug DiscoveryOralScott Wildman, wildman@biochem.wustl.edu
Y. Jane Tseng, yjtseng@csie.ntu.edu.tw
Drug DiscoveryOralScott Wildman, wildman@biochem.wustl.edu
Y. Jane Tseng, yjtseng@csie.ntu.edu.tw
Drug Discovery: Target-basedOralScott Wildman, wildman@biochem.wustl.edu
Y. Jane Tseng, yjtseng@csie.ntu.edu.tw
Emerging Technologies in Computational ChemistryOralCurtis Breneman, brenec@rpi.edu
Hewlett-Packard Outstanding Junior Faculty AwardPosterCarlos Simmerling, carlos.simmerling@stonybrook.edu
Material ScienceOral Emilio Xavier Esposito, emilio.esposito@gmail.comCINF
PMSE
Material ScienceOral Emilio Xavier Esposito, emilio.esposito@gmail.comCINF
PMSE
Material ScienceOral Emilio Xavier Esposito, emilio.esposito@gmail.comCINF
PMSE
MembranesOralMichael Feig, feig@msu.eduBIOL
MEDI
Mining Protein-Ligand Interaction SpaceOralVeerabahu Shanmugasundaram, Veerabahu.Shanmugasundaram@pfizer.com
Mehran Jalaie, mehran.jalaie@pfizer.com
Mining Protein-Ligand Interaction SpaceOral Mehran Jalaie, mehran.jalaie@pfizer.com
Veerabahu Shanmugasundaram, Veerabahu.Shanmugasundaram@pfizer.com
Mining Protein-Ligand Interaction SpaceOral Mehran Jalaie, mehran.jalaie@pfizer.com
Veerabahu Shanmugasundaram, Veerabahu.Shanmugasundaram@pfizer.com
Molecular MechanicsOral Michael Feig, feig@msu.eduPHYS
Molecular MechanicsOralMichael Feig, feig@msu.eduPHYS
Molecular MechanicsOralMichael Feig, feig@msu.eduPHYS
Molecular MechanicsOralMichael Feig, feig@msu.eduPHYS
Molecular MechanicsOralMichael Feig, feig@msu.edu
Poster SessionPoster Emilio Xavier Esposito, emilio.esposito@gmail.com
Predicting and Disrupting Protein InteractionsOralDmytro Kozakov, midas@bu.edu
Sandor Vajda, vajda@bu.edu
Ilya Vakser, vakser@ku.edu
Predicting and Disrupting Protein InteractionsOral Sandor Vajda, vajda@bu.edu
Ilya Vakser, vakser@ku.edu
Dmytro Kozakov, midas@bu.edu
Predicting and Disrupting Protein InteractionsOral Sandor Vajda, vajda@bu.edu
Ilya Vakser, vakser@ku.edu
Dmytro Kozakov, midas@bu.edu
Predicting and Disrupting Protein InteractionsOral Ilya Vakser, vakser@ku.edu
Dmytro Kozakov, midas@bu.edu
Sandor Vajda, vajda@bu.edu
Quantum ChemistryOral Eric Patterson, epatters@truman.eduPHYS
Quantum ChemistryOral Eric Patterson, epatters@truman.eduPHYS
Quantum ChemistryOral Eric Patterson, epatters@truman.eduPHYS
Quantum ChemistryOral Eric Patterson, epatters@truman.eduPHYS
Sci-MixSci-Mix Emilio Xavier Esposito, emilio.esposito@gmail.com

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