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Chemical Theory and Modelling Group
PSL University - Chimie ParisTech
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Latest Publications
Excited State Tracking during the Relaxation of Coordination Compounds
Journal of Computational Chemistry DOI: 10.1002/jcc.25800 The ability to locate minima on electronic excited states (ESs) potential...
In Silico Design of New Inhibitors Against Hemagglutinin of Influenza
The Journal of Physical Chemistry B 2019 DOI: 10.1021/acs.jpcb.8b10767 The RNA virus Influenza A is a serious public health problem with...
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