Title : Chemical Insight on Decreased Sensitivity of CL-20/TNT Cocrystal Revealed by ReaxFF MD Simulations.

Pub. Date : 2019 May 28

PMID : 30768269






1 Functional Relationships(s)
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1 The early formed active intermediates of NO2, NO3, NO, and N2O are confined and consumed by the reactions of the surrounding TNT or ring intermediates from TNT conversion, accounting for over 40% reactions of NO2 consumption. Nitrogen Dioxide NBL1, DAN family BMP antagonist Homo sapiens