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In silico mechanistic profiling to probe small molecule binding to sulfotransferases.

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Academic year: 2017

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Figure  2.    Solvent  Accessible  Surface  Area  (SAS)  of  binding  pockets  for  the  three  SULT1  isoforms  for  one  MD production
Table 4 shows the performance of the SVM classifier with and without  included  predicted  binding  energy  values
Figure 7.  Compound datasets preparation.

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