% '3-methyladenine'


config('3-methyladenine',[
        model(adenine,[
                diff(nit(3),nit(3,methyl))])]).

%%%% Model/Diff Config Rules for compound '3-methyladenine' %%%%

config(adenine,[
        model(purine,[
                diff(car(6,hyd),car(6,amine(10)))])]).

%%%% Model/Diff Config Rules for compound adenine %%%%

config(purine,[
        ring_system([
                ring([
                        car(6,hyd)&,
                        car(5)&,
                        car(4)&,
                        nit(3)&,
                        car(2,hyd)&,
                        nit(1)&]),
                ring([
                        nit(7)&,
                        car(8,hyd)&,
                        nit(9,hyd)&,
                        car(4)&,
                        car(5)&])],
                conjugate(1,pseudopos([car(4),car(5)]),2,pseudopos([car(4),car(5)]))])]).