apoCHARMM 1.0.0
High-performance molecular dynamics simulations on GPUs
 
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Files

 ApoCharmmError.h
 Declares categorized native errors and source-capturing error macros.
 
 PBC.h
 Declares apoCHARMM periodic-boundary and crystal identifiers.
 
 SelectionToken.h
 Declares lexical token types and token records for atom selections.