diff options
Diffstat (limited to 'graphics/mcf2graph/mcf_exa_soc.mp')
-rw-r--r-- | graphics/mcf2graph/mcf_exa_soc.mp | 11 |
1 files changed, 6 insertions, 5 deletions
diff --git a/graphics/mcf2graph/mcf_exa_soc.mp b/graphics/mcf2graph/mcf_exa_soc.mp index 65f884e412..9be5d18af1 100644 --- a/graphics/mcf2graph/mcf_exa_soc.mp +++ b/graphics/mcf2graph/mcf_exa_soc.mp @@ -1,14 +1,15 @@ %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%% -% Molecular Coding Format by Akira Yamaji 2022.02.27 +% Molecular Coding Format by Akira Yamaji 2022.03.13 %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%% -input mcf2graph; %%% it must be version 4.81 -message "* mcf_exa_soc 2022.02.27"; +input mcf2graph; %%% it must be version 4.82 +message "* mcf_exa_soc 2022.03.13"; message ""; %------------------------------------------------------------------------------ %%%%sw_frame:=Outside; %%%%sw_numbering:=Bond; %%%%sw_numbering:=Atom; %%%%sw_frame:=Atom; +sw_expand:=1; tag1:="J"; tag2:="C"; tag3:="fm"; tag4:="mw"; tag5:="EN"; tag6:="MW"; %------------------------------------------------------------------------------ %% outputformat:="png"; hppp:=vppp:=0.1; outputtemplate:="%j-%3c.png"; @@ -28,8 +29,8 @@ max_blength:=4mm; %------------------------------------------------------------------------------ %%%% beginfigm("t:EN","v:Caffeine") % select EN=Caffeine forever: -%%%% beginfigm("f:mcf_data_base","v+:*") % 'mcf_data_base.mcf'(default) -%%%% beginfigm("f:temp","v+:*") % use query output 'temp.mcf' +%%%% beginfigm("f:mcf_library","v+:*") % 'mcf_library.mcf'(default) +%%%% beginfigm("f:temp","v+:*") % use query output 'temp.mcf' %%%% beginfigm("v+:*") % select all beginfigm("t:EXA","v+:1") % 'v+:1': select EXA=1 if f_EOF=0: if check(mc)=0: MC(scantokens(mc)) fi fi |