This work is aimed at development of detailed molecular surface chemistry models for DSMC method, their implementation into the SMILE++ software system, verification and validation. An approach to construction of DSMC suface chemistry models based on macroscopic reaction rate data was proposed. The approach was applied to macroscopic data for the air mixture of Deutschmann et al. The resulting DSMC surface chemistry model was implemented into SMILE++ software system and verified for thermal equilibrium conditions.