pyEQL 1.4.0rc9__cp310-cp310-win_amd64.whl

This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.
Files changed (519) hide show
  1. pyEQL/__init__.py +50 -0
  2. pyEQL/_phreeqc.cp310-win_amd64.pyd +0 -0
  3. pyEQL/activity_correction.py +879 -0
  4. pyEQL/database/geothermal.dat +5693 -0
  5. pyEQL/database/llnl.dat +19305 -0
  6. pyEQL/database/phreeqc_license.txt +54 -0
  7. pyEQL/database/pyeql_db.json +35607 -0
  8. pyEQL/engines.py +1153 -0
  9. pyEQL/equilibrium.py +227 -0
  10. pyEQL/functions.py +281 -0
  11. pyEQL/phreeqc/__init__.py +5 -0
  12. pyEQL/phreeqc/bindings.cpp +84 -0
  13. pyEQL/phreeqc/core.py +239 -0
  14. pyEQL/phreeqc/database/Amm.dat +1968 -0
  15. pyEQL/phreeqc/database/CMakeLists.txt +32 -0
  16. pyEQL/phreeqc/database/ColdChem.dat +267 -0
  17. pyEQL/phreeqc/database/Concrete_PHR.dat +158 -0
  18. pyEQL/phreeqc/database/Concrete_PZ.dat +195 -0
  19. pyEQL/phreeqc/database/Kinec.v2.dat +12039 -0
  20. pyEQL/phreeqc/database/Kinec_v3.dat +12159 -0
  21. pyEQL/phreeqc/database/Makefile.am +28 -0
  22. pyEQL/phreeqc/database/Makefile.in +530 -0
  23. pyEQL/phreeqc/database/PHREEQC_ThermoddemV1.10_15Dec2020.dat +12965 -0
  24. pyEQL/phreeqc/database/Tipping_Hurley.dat +4137 -0
  25. pyEQL/phreeqc/database/__init__.py +0 -0
  26. pyEQL/phreeqc/database/core10.dat +6824 -0
  27. pyEQL/phreeqc/database/frezchem.dat +634 -0
  28. pyEQL/phreeqc/database/iso.dat +7235 -0
  29. pyEQL/phreeqc/database/llnl.dat +19310 -0
  30. pyEQL/phreeqc/database/minteq.dat +5654 -0
  31. pyEQL/phreeqc/database/minteq.v4.dat +13212 -0
  32. pyEQL/phreeqc/database/phreeqc.dat +1972 -0
  33. pyEQL/phreeqc/database/phreeqc_rates.dat +3158 -0
  34. pyEQL/phreeqc/database/pitzer.dat +1044 -0
  35. pyEQL/phreeqc/database/sit.dat +14348 -0
  36. pyEQL/phreeqc/database/wateq4f.dat +4036 -0
  37. pyEQL/phreeqc/ext/README.md +10 -0
  38. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/CMakeLists.txt +476 -0
  39. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/INSTALL +302 -0
  40. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/IPhreeqc.rc +61 -0
  41. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/IPhreeqcConfig.cmake.in +4 -0
  42. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/Makefile.am +8 -0
  43. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/Makefile.in +816 -0
  44. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/aclocal.m4 +1217 -0
  45. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/ALL_BUILD.vcxproj +185 -0
  46. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/ALL_BUILD.vcxproj.filters +8 -0
  47. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/CMakeFiles/generate.stamp +1 -0
  48. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/CMakeFiles/generate.stamp.depend +79 -0
  49. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/CTestTestfile.cmake +6 -0
  50. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/Continuous.vcxproj +240 -0
  51. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/Continuous.vcxproj.filters +17 -0
  52. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/DartConfiguration.tcl +109 -0
  53. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/Experimental.vcxproj +240 -0
  54. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/Experimental.vcxproj.filters +17 -0
  55. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/INSTALL.vcxproj +209 -0
  56. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/INSTALL.vcxproj.filters +13 -0
  57. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/CSelectedOutput.obj +0 -0
  58. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/Dictionary.obj +0 -0
  59. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/ExchComp.obj +0 -0
  60. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/Exchange.obj +0 -0
  61. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/GasComp.obj +0 -0
  62. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/GasPhase.obj +0 -0
  63. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/IPhreeqc.lib.recipe +11 -0
  64. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/IPhreeqc.obj +0 -0
  65. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/IPhreeqc.tlog/CL.command.1.tlog +0 -0
  66. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/IPhreeqc.tlog/CL.read.1.tlog +0 -0
  67. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/IPhreeqc.tlog/CL.write.1.tlog +0 -0
  68. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/IPhreeqc.tlog/Cl.items.tlog +82 -0
  69. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/IPhreeqc.tlog/CustomBuild.command.1.tlog +10 -0
  70. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/IPhreeqc.tlog/CustomBuild.read.1.tlog +78 -0
  71. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/IPhreeqc.tlog/CustomBuild.write.1.tlog +2 -0
  72. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/IPhreeqc.tlog/IPhreeqc.lastbuildstate +2 -0
  73. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/IPhreeqc.tlog/Lib-link.read.1.tlog +0 -0
  74. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/IPhreeqc.tlog/Lib-link.write.1.tlog +0 -0
  75. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/IPhreeqc.tlog/Lib.command.1.tlog +0 -0
  76. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/IPhreeqcLib.obj +0 -0
  77. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/IPhreeqc_interface_F.obj +0 -0
  78. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/ISolution.obj +0 -0
  79. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/ISolutionComp.obj +0 -0
  80. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/Keywords.obj +0 -0
  81. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/KineticsComp.obj +0 -0
  82. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/NameDouble.obj +0 -0
  83. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/NumKeyword.obj +0 -0
  84. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/PBasic.obj +0 -0
  85. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/PHRQ_base.obj +0 -0
  86. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/PHRQ_io.obj +0 -0
  87. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/PHRQ_io_output.obj +0 -0
  88. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/PPassemblage.obj +0 -0
  89. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/PPassemblageComp.obj +0 -0
  90. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/Parser.obj +0 -0
  91. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/Phreeqc.obj +0 -0
  92. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/Pressure.obj +0 -0
  93. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/Reaction.obj +0 -0
  94. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/ReadClass.obj +0 -0
  95. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/SS.obj +0 -0
  96. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/SSassemblage.obj +0 -0
  97. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/SScomp.obj +0 -0
  98. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/SelectedOutput.obj +0 -0
  99. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/Serializer.obj +0 -0
  100. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/Solution.obj +0 -0
  101. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/SolutionIsotope.obj +0 -0
  102. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/StorageBin.obj +0 -0
  103. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/StorageBinList.obj +0 -0
  104. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/Surface.obj +0 -0
  105. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/SurfaceCharge.obj +0 -0
  106. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/SurfaceComp.obj +0 -0
  107. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/System.obj +0 -0
  108. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/Temperature.obj +0 -0
  109. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/Use.obj +0 -0
  110. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/UserPunch.obj +0 -0
  111. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/Utils.obj +0 -0
  112. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/Var.obj +0 -0
  113. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/advection.obj +0 -0
  114. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/basicsubs.obj +0 -0
  115. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/cl1.obj +0 -0
  116. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/cvdense.obj +0 -0
  117. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/cvode.obj +0 -0
  118. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/cxxKinetics.obj +0 -0
  119. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/cxxMix.obj +0 -0
  120. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/dense.obj +0 -0
  121. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/dumper.obj +0 -0
  122. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/gases.obj +0 -0
  123. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/input.obj +0 -0
  124. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/integrate.obj +0 -0
  125. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/inverse.obj +0 -0
  126. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/isotopes.obj +0 -0
  127. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/kinetics.obj +0 -0
  128. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/mainsubs.obj +0 -0
  129. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/model.obj +0 -0
  130. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/nvector.obj +0 -0
  131. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/nvector_serial.obj +0 -0
  132. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/parse.obj +0 -0
  133. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/phqalloc.obj +0 -0
  134. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/pitzer.obj +0 -0
  135. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/pitzer_structures.obj +0 -0
  136. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/prep.obj +0 -0
  137. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/print.obj +0 -0
  138. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/read.obj +0 -0
  139. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/readtr.obj +0 -0
  140. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/runner.obj +0 -0
  141. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/sit.obj +0 -0
  142. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/smalldense.obj +0 -0
  143. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/spread.obj +0 -0
  144. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/step.obj +0 -0
  145. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/structures.obj +0 -0
  146. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/sundialsmath.obj +0 -0
  147. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/tally.obj +0 -0
  148. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/tidy.obj +0 -0
  149. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/transport.obj +0 -0
  150. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.dir/Release/utilities.obj +0 -0
  151. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.sln +116 -0
  152. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.vcxproj +443 -0
  153. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/IPhreeqc.vcxproj.filters +456 -0
  154. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/Nightly.vcxproj +240 -0
  155. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/Nightly.vcxproj.filters +17 -0
  156. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/NightlyMemoryCheck.vcxproj +240 -0
  157. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/NightlyMemoryCheck.vcxproj.filters +17 -0
  158. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/Release/IPhreeqc.lib +0 -0
  159. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/build/cmake_install.cmake +40 -0
  160. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/config/ar-lib +270 -0
  161. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/config/compile +347 -0
  162. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/config/config.guess +1441 -0
  163. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/config/config.sub +1813 -0
  164. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/config/depcomp +791 -0
  165. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/config/install-sh +508 -0
  166. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/config/ltmain.sh +11156 -0
  167. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/config/missing +215 -0
  168. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/config/test-driver +148 -0
  169. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/configure +23867 -0
  170. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/configure.ac +136 -0
  171. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/database/Amm.dat +1968 -0
  172. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/database/CMakeLists.txt +32 -0
  173. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/database/ColdChem.dat +267 -0
  174. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/database/Concrete_PHR.dat +158 -0
  175. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/database/Concrete_PZ.dat +195 -0
  176. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/database/Kinec.v2.dat +12039 -0
  177. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/database/Kinec_v3.dat +12159 -0
  178. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/database/Makefile.am +28 -0
  179. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/database/Makefile.in +530 -0
  180. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/database/PHREEQC_ThermoddemV1.10_15Dec2020.dat +12965 -0
  181. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/database/Tipping_Hurley.dat +4137 -0
  182. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/database/core10.dat +6824 -0
  183. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/database/frezchem.dat +634 -0
  184. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/database/iso.dat +7235 -0
  185. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/database/llnl.dat +19310 -0
  186. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/database/minteq.dat +5654 -0
  187. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/database/minteq.v4.dat +13212 -0
  188. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/database/phreeqc.dat +1972 -0
  189. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/database/phreeqc_rates.dat +3158 -0
  190. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/database/pitzer.dat +1044 -0
  191. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/database/sit.dat +14348 -0
  192. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/database/wateq4f.dat +4036 -0
  193. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/doc/CMakeLists.txt +35 -0
  194. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/doc/IPhreeqc.pdf +0 -0
  195. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/doc/Makefile.am +24 -0
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  389. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/Pressure.h +43 -0
  390. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/Reaction.cxx +284 -0
  391. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/Reaction.h +57 -0
  392. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/ReadClass.cxx +1150 -0
  393. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/SS.cxx +609 -0
  394. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/SS.h +128 -0
  395. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/SSassemblage.cxx +317 -0
  396. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/SSassemblage.h +59 -0
  397. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/SScomp.cxx +297 -0
  398. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/SScomp.h +66 -0
  399. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/SelectedOutput.cpp +115 -0
  400. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/SelectedOutput.h +209 -0
  401. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/Serializer.cxx +213 -0
  402. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/Serializer.h +42 -0
  403. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/Solution.cxx +1795 -0
  404. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/Solution.h +154 -0
  405. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/SolutionIsotope.cxx +333 -0
  406. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/SolutionIsotope.h +85 -0
  407. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/StorageBin.cxx +1507 -0
  408. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/StorageBin.h +141 -0
  409. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/StorageBinList.cpp +358 -0
  410. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/StorageBinList.h +81 -0
  411. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/Surface.cxx +837 -0
  412. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/Surface.h +108 -0
  413. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/SurfaceCharge.cxx +617 -0
  414. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/SurfaceCharge.h +137 -0
  415. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/SurfaceComp.cxx +509 -0
  416. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/SurfaceComp.h +70 -0
  417. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/System.cxx +103 -0
  418. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/System.h +89 -0
  419. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/Temperature.cxx +423 -0
  420. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/Temperature.h +42 -0
  421. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/Use.cpp +78 -0
  422. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/Use.h +159 -0
  423. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/UserPunch.cpp +32 -0
  424. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/UserPunch.h +39 -0
  425. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/ZedGraph.dll +0 -0
  426. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/advection.cpp +140 -0
  427. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/basicsubs.cpp +4333 -0
  428. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/cl1.cpp +881 -0
  429. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/common/PHRQ_base.cxx +117 -0
  430. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/common/PHRQ_base.h +48 -0
  431. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/common/PHRQ_exports.h +20 -0
  432. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/common/PHRQ_io.cpp +914 -0
  433. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/common/PHRQ_io.h +207 -0
  434. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/common/Parser.cxx +1331 -0
  435. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/common/Parser.h +310 -0
  436. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/common/Utils.cxx +263 -0
  437. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/common/Utils.h +29 -0
  438. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/common/phrqtype.h +18 -0
  439. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/cvdense.cpp +566 -0
  440. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/cvdense.h +267 -0
  441. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/cvode.cpp +3939 -0
  442. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/cvode.h +940 -0
  443. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/cxxKinetics.cxx +617 -0
  444. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/cxxKinetics.h +78 -0
  445. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/cxxMix.cxx +154 -0
  446. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/cxxMix.h +58 -0
  447. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/dense.cpp +175 -0
  448. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/dense.h +341 -0
  449. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/dumper.cpp +277 -0
  450. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/dumper.h +60 -0
  451. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/gases.cpp +748 -0
  452. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/global_structures.h +1672 -0
  453. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/input.cpp +133 -0
  454. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/integrate.cpp +1219 -0
  455. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/inverse.cpp +5135 -0
  456. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/isotopes.cpp +1813 -0
  457. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/kinetics.cpp +3180 -0
  458. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/mainsubs.cpp +2320 -0
  459. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/model.cpp +5843 -0
  460. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/nvector.cpp +272 -0
  461. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/nvector.h +485 -0
  462. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/nvector_serial.cpp +1032 -0
  463. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/nvector_serial.h +369 -0
  464. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/parse.cpp +1044 -0
  465. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/phqalloc.cpp +316 -0
  466. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/phqalloc.h +47 -0
  467. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/pitzer.cpp +2709 -0
  468. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/pitzer_structures.cpp +225 -0
  469. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/prep.cpp +6267 -0
  470. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/print.cpp +3673 -0
  471. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/read.cpp +10245 -0
  472. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/readtr.cpp +1495 -0
  473. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/runner.cpp +158 -0
  474. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/runner.h +33 -0
  475. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/sit.cpp +1684 -0
  476. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/smalldense.cpp +324 -0
  477. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/smalldense.h +261 -0
  478. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/spread.cpp +1309 -0
  479. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/step.cpp +1566 -0
  480. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/structures.cpp +3381 -0
  481. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/sundialsmath.cpp +133 -0
  482. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/sundialsmath.h +162 -0
  483. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/sundialstypes.h +183 -0
  484. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/tally.cpp +1288 -0
  485. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/tidy.cpp +5600 -0
  486. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/transport.cpp +6403 -0
  487. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/phreeqcpp/utilities.cpp +1339 -0
  488. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/src/thread.h +64 -0
  489. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/tests/CMakeLists.txt +133 -0
  490. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/tests/Makefile.am +45 -0
  491. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/tests/Makefile.in +1128 -0
  492. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/tests/ex2.in +26 -0
  493. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/tests/main.f90 +31 -0
  494. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/tests/main77.f +6 -0
  495. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/tests/main_fortran.cxx +8 -0
  496. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/tests/phreeqc.dat.in +1556 -0
  497. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/tests/test_c.c +148 -0
  498. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/tests/test_cxx.cxx +152 -0
  499. pyEQL/phreeqc/ext/iphreeqc-3.8.6-17100/tests/test_f90.F90 +328 -0
  500. pyEQL/phreeqc/iphreeqc_wrapper.cpp +75 -0
  501. pyEQL/phreeqc/solution.py +74 -0
  502. pyEQL/phreeqc/var.py +50 -0
  503. pyEQL/presets/Ringers lactate.yaml +20 -0
  504. pyEQL/presets/__init__.py +17 -0
  505. pyEQL/presets/normal saline.yaml +17 -0
  506. pyEQL/presets/rainwater.yaml +17 -0
  507. pyEQL/presets/seawater.yaml +29 -0
  508. pyEQL/presets/urine.yaml +26 -0
  509. pyEQL/presets/wastewater.yaml +21 -0
  510. pyEQL/py.typed +0 -0
  511. pyEQL/salt_ion_match.py +112 -0
  512. pyEQL/solute.py +163 -0
  513. pyEQL/solution.py +2714 -0
  514. pyEQL/utils.py +237 -0
  515. pyeql-1.4.0rc9.dist-info/METADATA +130 -0
  516. pyeql-1.4.0rc9.dist-info/RECORD +519 -0
  517. pyeql-1.4.0rc9.dist-info/WHEEL +5 -0
  518. pyeql-1.4.0rc9.dist-info/licenses/AUTHORS.md +21 -0
  519. pyeql-1.4.0rc9.dist-info/licenses/LICENSE.txt +20 -0
@@ -0,0 +1,1184 @@
1
+ #pragma once
2
+ #include <Windows.h>
3
+ #include <cassert>
4
+
5
+ namespace zdg_ui2 {
6
+ using namespace System;
7
+ //using namespace System::ComponentModel;
8
+ using namespace System::Resources;
9
+ using namespace System::Windows::Forms;
10
+ using namespace System::Drawing;
11
+ using namespace System::Drawing::Imaging;
12
+ using namespace System::Threading;
13
+ using namespace ZedGraph;
14
+ //using namespace System::Runtime::InteropServices;
15
+ //[DllImport("gdi32.dll")]
16
+ ////extern IntPtr CopyEnhMetaFileA(IntPtr hemfSrc, System::Text::StringBuilder* hNULL);
17
+ //extern IntPtr CopyEnhMetaFileA(IntPtr hemfSrc, String^ hNULL);
18
+ // Form1 is only used with MULTICHART
19
+ public ref class ChartObj : public System::Object
20
+ {
21
+ public: ChartObject* chartobject_ptr;
22
+ public: ChartObj(ChartObject* ptr)
23
+ {
24
+ this->chartobject_ptr = ptr;
25
+ }
26
+ };
27
+
28
+ public ref class Form1 : public System::Windows::Forms::Form
29
+ {
30
+ public: long int tickStart;
31
+ public: Form1(ChartObject *ptr)
32
+ {
33
+ this->chartobject_ptr = ptr;
34
+ if (Phreeqc* ptr = this->chartobject_ptr->Get_phreeqc())
35
+ {
36
+ ptr->Get_chart_handler().Increment_active_charts();
37
+ }
38
+ InitializeComponent();
39
+ col_use = 0;
40
+ symbol_use = 0;
41
+ Y2 = false;
42
+ phreeqc_done = false;
43
+ Y2show = false;
44
+ background = true;
45
+ hints = true;
46
+ grid = true;
47
+ }
48
+ static void ThreadForm(Object^ data)
49
+ {
50
+ ChartObject *ptr = ((ChartObj^)(data))->chartobject_ptr;
51
+ Form1 ^myForm = gcnew Form1(ptr);
52
+ myForm->ShowDialog();
53
+ myForm->~Form1();
54
+ }
55
+ private: bool phreeqc_done;
56
+
57
+ private: void SetSize()
58
+ {
59
+ zg1->Location = Point( 0, 0 );
60
+ // Leave a small margin around the outside of the control
61
+ zg1->Size = System::Drawing::Size( ClientRectangle.Width - 0,
62
+ ClientRectangle.Height - 0 );
63
+ }
64
+
65
+ System::Void MyFormClosingEventHandler(
66
+ System::Object^ sender,
67
+ System::Windows::Forms::FormClosingEventArgs ^e)
68
+ {
69
+ ChartObject *chart = this->chartobject_ptr;
70
+ if (chart != NULL)
71
+ {
72
+ chart->Set_done(true);
73
+ System::Threading::Interlocked::Exchange(this->chartobject_ptr->usingResource, 0);
74
+ if (Phreeqc* ptr = chart->Get_phreeqc())
75
+ {
76
+ ptr->Get_chart_handler().Decrement_active_charts();
77
+ //chart->Set_phreeqc(NULL);
78
+ }
79
+ }
80
+ this->chartobject_ptr = NULL;
81
+ }
82
+
83
+ System::Void Form1_Load(System::Object ^sender, System::EventArgs ^e)
84
+ {
85
+ CreateGraph( zg1 );
86
+ SetSize();
87
+ }
88
+
89
+ System::Void Form1_Resize(System::Object ^sender, System::EventArgs ^e)
90
+ {
91
+ SetSize();
92
+ }
93
+
94
+ //static bool LogX, LogY, LogY2;
95
+ bool LogX, LogY, LogY2;
96
+ private: bool check_neg_log( int i, int i2)
97
+ {
98
+ ChartObject *chart = this->chartobject_ptr;
99
+ if (chart == NULL) return false;
100
+ std::vector<CurveObject *> &Curves = chart->Get_Curves();
101
+ if (LogX && chart->Get_axis_scale_x()[4] == 10.0 &&
102
+ Curves[i]->Get_x()[i2] <= 0)
103
+ {
104
+ if (Phreeqc* ptr = chart->Get_phreeqc())
105
+ {
106
+ ptr->warning_msg("Obtained x_value <= 0, removing point...");
107
+ }
108
+ //axis_scale_x[4] = NA; /* if reverting to linear... */
109
+ //LogX = false;
110
+ return true;
111
+ }
112
+ if (Curves[i]->Get_y()[i2] <= 0 &&
113
+ (chart->Get_axis_scale_y()[4] == 10.0 ||
114
+ chart->Get_axis_scale_y2()[4] == 10.0))
115
+ {
116
+ if (Curves[i]->Get_y_axis() == 2 && LogY2)
117
+ {
118
+ if (Phreeqc* ptr = chart->Get_phreeqc())
119
+ {
120
+ ptr->warning_msg("Obtained sy_value <= 0, removing point......");
121
+ }
122
+ //axis_scale_y2[4] = NA;
123
+ //LogY2 = false;
124
+ return true;
125
+ }
126
+ else if (LogY)
127
+ {
128
+ if (Phreeqc* ptr = chart->Get_phreeqc())
129
+ {
130
+ ptr->warning_msg("Obtained y_value <= 0, removing point......");
131
+ }
132
+ //axis_scale_y[4] = NA;
133
+ //LogY = false;
134
+ return true;
135
+ }
136
+ }
137
+ return false;
138
+ }
139
+
140
+ private: PointPairList ^list;
141
+ int col_use, symbol_use;
142
+ bool Y2, Y2show;
143
+ // static cli::array<String^> ^ColorList = {"Red", "Green", "Blue", "Orange", "Magenta", "Yellow", "Black", "Cyan", "Brown", "Lime", "Gray" };
144
+ static cli::array<String^> ^ColorList = {"Red", "Green", "Blue", "Orange", "Magenta", "Black", "Cyan", "Brown", "Lime", "Gray" };
145
+ bool background, hints, grid;
146
+
147
+ ZedGraph::GraphObjList ^GOL_no_hints;
148
+ ZedGraph::GraphObjList ^GOL_hints;
149
+
150
+ void DefineCurves(GraphPane ^myPane, int init)
151
+ {
152
+ ChartObject *chart = this->chartobject_ptr;
153
+ if (chart == NULL)
154
+ {
155
+ return;
156
+ }
157
+ std::vector<CurveObject *> Curves;
158
+ size_t i;
159
+ for (i = 0; i < chart->Get_CurvesCSV().size(); i++)
160
+ {
161
+ Curves.push_back(chart->Get_CurvesCSV()[i]);
162
+ }
163
+ for (i = 0; i < chart->Get_Curves().size(); i++)
164
+ {
165
+ Curves.push_back(chart->Get_Curves()[i]);
166
+ }
167
+
168
+ chart->Set_curve_added(false);
169
+
170
+ // Set the titles and axis labels
171
+ myPane->Title->Text = gcnew String(chart->Get_chart_title().c_str());
172
+ if (chart->Get_axis_titles().size() > 0)
173
+ myPane->XAxis->Title->Text = gcnew String(chart->Get_axis_titles()[0].c_str());
174
+ if (chart->Get_axis_titles().size() > 1)
175
+ myPane->YAxis->Title->Text = gcnew String(chart->Get_axis_titles()[1].c_str());
176
+ if (chart->Get_axis_titles().size() > 2)
177
+ myPane->Y2Axis->Title->Text = gcnew String(chart->Get_axis_titles()[2].c_str());
178
+
179
+ LineItem ^myCurve;
180
+
181
+ Color col;
182
+
183
+ String ^s_t;
184
+ if (chart->Get_axis_scale_x()[4] == 10.0) LogX = true;
185
+ else LogX = false;
186
+ if (chart->Get_axis_scale_y()[4] == 10.0) LogY = true;
187
+ else LogY = false;
188
+ if (chart->Get_axis_scale_y2()[4] == 10.0) LogY2 = true;
189
+ else LogY2 = false;
190
+
191
+ //Rewrite all curves
192
+ zg1->GraphPane->CurveList->Clear();
193
+ for (size_t i = 0; i < Curves.size(); i++)
194
+ {
195
+ // even curves with no data
196
+ //if (Curves[i]->Get_x().size() == 0) continue;
197
+ list = gcnew PointPairList();
198
+ if (Curves[i]->Get_y_axis() == 2)
199
+ {
200
+ Y2 = true;
201
+ Y2show = true;
202
+ }
203
+ else
204
+ Y2 = false;
205
+ for (int i2 = 0; (i2 < (int) Curves[i]->Get_x().size()); i2++)
206
+ {
207
+ if ((LogX && Curves[i]->Get_x()[i2] <=0)
208
+ || (LogY && !Y2 && Curves[i]->Get_y()[i2] <=0)
209
+ || (LogY2 && Y2 && Curves[i]->Get_y()[i2] <=0))
210
+ continue;
211
+ else
212
+ list->Add( Curves[i]->Get_x()[i2], Curves[i]->Get_y()[i2] );
213
+ }
214
+
215
+ col = Color::FromName(gcnew String(Curves[i]->Get_color().c_str()));
216
+ if (!col.IsKnownColor)
217
+ {
218
+ col = Color::FromName(ColorList[col_use]);
219
+ std::string newcol;
220
+ ToString(col.ToString(), newcol);
221
+ Utilities::replace("Color [","",newcol);
222
+ Utilities::replace("]","",newcol);
223
+ Curves[i]->Set_color(newcol);
224
+
225
+ }
226
+ if (++col_use > 6) col_use = 0;
227
+
228
+ SymbolType symb = chart->Return_SymbolType
229
+ (Curves[i]->Get_symbol());
230
+
231
+ // id
232
+ s_t = gcnew String(Curves[i]->Get_id().c_str());
233
+
234
+
235
+ // Add curve to chart
236
+ myCurve = myPane->AddCurve( s_t, list, col, symb );
237
+
238
+
239
+ // Curve with no points is invisible
240
+ if (Curves[i]->Get_x().size() == 0)
241
+ {
242
+ myCurve->IsVisible = false;
243
+ myCurve->Label->IsVisible = false;
244
+ }
245
+
246
+ if (Curves[i]->Get_line_w() > 0.0)
247
+ myCurve->Line->Width = (float) Curves[i]->Get_line_w();
248
+ else
249
+ myCurve->Line->IsVisible = false;
250
+ /* hmm... dash/dot don`t display well */
251
+ // myCurve->Line->Style = System::Drawing::Drawing2D::DashStyle::Dot;
252
+ myCurve->Symbol->Fill = gcnew Fill( Color::FromName("White") );
253
+ if (Curves[i]->Get_symbol_size() > 0.0)
254
+ myCurve->Symbol->Size = (float) Curves[i]->Get_symbol_size();
255
+ else
256
+ myCurve->Symbol->IsVisible = false;
257
+ myCurve->Symbol->Border->Width = (float) Curves[i]->Get_line_w();
258
+ if (Y2)
259
+ myCurve->IsY2Axis = true;
260
+ delete list;
261
+ }
262
+
263
+ if (Y2show)
264
+ myPane->Legend->Position = ZedGraph::LegendPos::TopCenter;
265
+ else
266
+ myPane->Legend->Position = ZedGraph::LegendPos::Right;
267
+ myPane->Legend->FontSpec->Size = 12;
268
+ myPane->Legend->FontSpec->IsBold = false;
269
+
270
+ // Show the x axis grid
271
+ myPane->XAxis->MajorGrid->IsVisible = true;
272
+ if (fabs(chart->Get_axis_scale_x()[0] - NA) > 1e-3)
273
+ myPane->XAxis->Scale->Min = chart->Get_axis_scale_x()[0];
274
+ else
275
+ myPane->XAxis->Scale->MinAuto = true;
276
+ if (fabs(chart->Get_axis_scale_x()[1] - NA) > 1e-3)
277
+ myPane->XAxis->Scale->Max = chart->Get_axis_scale_x()[1];
278
+ else
279
+ myPane->XAxis->Scale->MaxAuto = true;
280
+ if (fabs(chart->Get_axis_scale_x()[2] - NA) > 1e-3)
281
+ myPane->XAxis->Scale->MajorStep = chart->Get_axis_scale_x()[2];
282
+ else
283
+ myPane->XAxis->Scale->MajorStepAuto = true;
284
+ if (fabs(chart->Get_axis_scale_x()[3] - NA) > 1e-3)
285
+ {
286
+ myPane->XAxis->Scale->MinorStep = chart->Get_axis_scale_x()[3];
287
+ if (chart->Get_axis_scale_x()[3] == 0.0)
288
+ // remove minor tics
289
+ myPane->XAxis->MinorTic->Size = 0;
290
+ }
291
+ else
292
+ myPane->XAxis->Scale->MinorStepAuto = true;
293
+ if (chart->Get_axis_scale_x()[4] == 10.0)
294
+ myPane->XAxis->Type = AxisType::Log;
295
+
296
+ // Make the Y axis scale red
297
+ // myPane->YAxis->Scale->FontSpec->FontColor = Color::Red;
298
+ // myPane->YAxis->Title->FontSpec->FontColor = Color::Red;
299
+ // turn off the opposite tics so the Y tics don`t show up on the Y2 axis
300
+ if (Y2show)
301
+ {
302
+ myPane->YAxis->MajorTic->IsOpposite = false;
303
+ myPane->YAxis->MinorTic->IsOpposite = false;
304
+ }
305
+ // Don`t display the Y zero line
306
+ myPane->YAxis->MajorGrid->IsZeroLine = false;
307
+ // Align the Y axis labels so they are flush to the axis
308
+ myPane->YAxis->Scale->Align = AlignP::Inside;
309
+ myPane->YAxis->MajorGrid->IsVisible = true;
310
+ if (fabs(chart->Get_axis_scale_y()[0] - NA) > 1e-3)
311
+ myPane->YAxis->Scale->Min = chart->Get_axis_scale_y()[0];
312
+ else
313
+ myPane->YAxis->Scale->MinAuto = true;
314
+ if (fabs(chart->Get_axis_scale_y()[1] - NA) > 1e-3)
315
+ myPane->YAxis->Scale->Max = chart->Get_axis_scale_y()[1];
316
+ else
317
+ myPane->YAxis->Scale->MaxAuto = true;
318
+ if (fabs(chart->Get_axis_scale_y()[2] - NA) > 1e-3)
319
+ myPane->YAxis->Scale->MajorStep = chart->Get_axis_scale_y()[2];
320
+ else
321
+ myPane->YAxis->Scale->MajorStepAuto = true;
322
+ if (fabs(chart->Get_axis_scale_y()[3] - NA) > 1e-3)
323
+ {
324
+ myPane->YAxis->Scale->MinorStep = chart->Get_axis_scale_y()[3];
325
+ if (chart->Get_axis_scale_y()[3] == 0.0)
326
+ // remove minor tics
327
+ myPane->YAxis->MinorTic->Size = 0;
328
+ }
329
+ else
330
+ myPane->YAxis->Scale->MinorStepAuto = true;
331
+ if (chart->Get_axis_scale_y()[4] == 10.0)
332
+ myPane->YAxis->Type = AxisType::Log;
333
+
334
+ // Enable the Y2 axis display
335
+ if (Y2show)
336
+ {
337
+ myPane->Y2Axis->IsVisible = true;
338
+ // Make the Y2 axis scale blue
339
+ // myPane->Y2Axis->Scale->FontSpec->FontColor = Color::Blue;
340
+ // myPane->Y2Axis->Title->FontSpec->FontColor = Color::Blue;
341
+ // turn off the opposite tics so the Y2 tics don`t show up on the Y axis
342
+ myPane->Y2Axis->MajorTic->IsOpposite = false;
343
+ myPane->Y2Axis->MinorTic->IsOpposite = false;
344
+ // Don`t display the Y2 axis grid lines
345
+ myPane->Y2Axis->MajorGrid->IsVisible = false;
346
+ // Align the Y2 axis labels so they are flush to the axis
347
+ myPane->Y2Axis->Scale->Align = AlignP::Inside;
348
+
349
+ if (fabs(chart->Get_axis_scale_y2()[0] - NA) > 1e-3)
350
+ myPane->Y2Axis->Scale->Min = chart->Get_axis_scale_y2()[0];
351
+ else
352
+ myPane->Y2Axis->Scale->MinAuto = true;
353
+ if (fabs(chart->Get_axis_scale_y2()[1] - NA) > 1e-3)
354
+ myPane->Y2Axis->Scale->Max = chart->Get_axis_scale_y2()[1];
355
+ else
356
+ myPane->Y2Axis->Scale->MaxAuto = true;
357
+ if (fabs(chart->Get_axis_scale_y2()[2] - NA) > 1e-3)
358
+ myPane->Y2Axis->Scale->MajorStep = chart->Get_axis_scale_y2()[2];
359
+ else
360
+ myPane->Y2Axis->Scale->MajorStepAuto = true;
361
+ if (fabs(chart->Get_axis_scale_y2()[3] - NA) > 1e-3)
362
+ {
363
+ myPane->Y2Axis->Scale->MinorStep = chart->Get_axis_scale_y2()[3];
364
+ if (chart->Get_axis_scale_y2()[3] == 0.0)
365
+ // remove minor tics
366
+ myPane->Y2Axis->MinorTic->Size = 0;
367
+ }
368
+ else
369
+ myPane->Y2Axis->Scale->MinorStepAuto = true;
370
+ if (chart->Get_axis_scale_y2()[4] == 10.0)
371
+ myPane->Y2Axis->Type = AxisType::Log;
372
+ }
373
+
374
+ myPane->XAxis->MinorTic->IsOutside = false;
375
+ myPane->XAxis->MajorTic->IsOutside = false;
376
+ myPane->YAxis->MinorTic->IsOutside = false;
377
+ myPane->YAxis->MajorTic->IsOutside = false;
378
+ myPane->Y2Axis->MinorTic->IsOutside = false;
379
+ myPane->Y2Axis->MajorTic->IsOutside = false;
380
+
381
+ // Fill the axis background with a gradient
382
+ //myPane->Chart->Fill = gcnew Fill( Color::White, Color::LightYellow, 45.0f ); /* FromArgb(255, 255, 224) */
383
+ if (this->background)
384
+ {
385
+ myPane->Chart->Fill = gcnew Fill( Color::White, Color::FromArgb(255, 255, 230), 45.0f );
386
+ }
387
+ else
388
+ {
389
+ myPane->Chart->Fill = gcnew Fill( Color::White, Color::White, 45.0f );
390
+ }
391
+ if (this->grid)
392
+ {
393
+ myPane->XAxis->MajorGrid->IsVisible = true;
394
+ myPane->YAxis->MajorGrid->IsVisible = true;
395
+ }
396
+ else
397
+ {
398
+ myPane->XAxis->MajorGrid->IsVisible = false;
399
+ myPane->YAxis->MajorGrid->IsVisible = false;
400
+ }
401
+ // normalize pane size...
402
+ myPane->BaseDimension = 8.0F;
403
+ // increase bottom margin to accommodate text options...
404
+ myPane->Margin->Bottom = 15.0F;
405
+
406
+ // Make sure auto scale, Refresh
407
+ zg1->AxisChange();
408
+ zg1->Refresh();
409
+
410
+ }
411
+
412
+ public: void CreateGraph( ZedGraphControl ^z1 ) {
413
+ // Get a reference to the GraphPane instance in the ZedGraphControl
414
+ GraphPane ^myPane = z1->GraphPane;
415
+
416
+ // lock thread
417
+ while (0 != System::Threading::Interlocked::CompareExchange(this->chartobject_ptr->usingResource, 2, 0))
418
+ {
419
+ System::Threading::Thread::Sleep(5);
420
+ }
421
+
422
+ try
423
+ {
424
+
425
+ DefineCurves(myPane, 0);
426
+
427
+ // Add text boxes with instructions...
428
+ GOL_no_hints = gcnew ZedGraph::GraphObjList(myPane->GraphObjList);
429
+
430
+ TextObj ^text;
431
+ text = gcnew TextObj(
432
+ L" Click right mouse for options... \0",
433
+ 0.01f, 0.99f, CoordType::PaneFraction, AlignH::Left, AlignV::Bottom );
434
+ text->FontSpec->StringAlignment = StringAlignment::Near;
435
+ text->FontSpec->Size = 10;
436
+ text->FontSpec->FontColor = Color::Red;
437
+ text->ZOrder = ZOrder::H_BehindAll;
438
+ myPane->GraphObjList->Add( text );
439
+ text = gcnew TextObj(
440
+ L" Press Alt + F4 to quit",
441
+ 0.81f, 0.99f, CoordType::PaneFraction, AlignH::Left, AlignV::Bottom );
442
+ text->FontSpec->StringAlignment = StringAlignment::Near;
443
+ text->FontSpec->Size = 10;
444
+ text->FontSpec->FontColor = Color::Red;
445
+ text->ZOrder = ZOrder::H_BehindAll;
446
+ myPane->GraphObjList->Add( text );
447
+
448
+ GOL_hints = gcnew ZedGraph::GraphObjList(myPane->GraphObjList);
449
+ if (this->hints)
450
+ {
451
+ myPane->GraphObjList = GOL_hints;
452
+ }
453
+ else
454
+ {
455
+ myPane->GraphObjList = GOL_no_hints;
456
+ }
457
+
458
+ // Enable scrollbars if needed...
459
+ /*z1->IsShowHScrollBar = true;
460
+ z1->IsShowVScrollBar = true;
461
+ z1->IsAutoScrollRange = true;
462
+ z1->IsScrollY2 = true;*/
463
+
464
+ // OPTIONAL: Show tooltips when the mouse hovers over a point
465
+ z1->IsShowPointValues = false;
466
+ z1->PointValueEvent += gcnew ZedGraphControl::PointValueHandler( this,
467
+ &Form1::MyPointValueHandler );
468
+
469
+ // OPTIONAL: Add a custom context menu item
470
+ z1->ContextMenuBuilder += gcnew ZedGraphControl::ContextMenuBuilderEventHandler(
471
+ this, &Form1::MyContextMenuBuilder );
472
+
473
+ // OPTIONAL: Handle the Zoom Event
474
+ z1->ZoomEvent += gcnew ZedGraphControl::ZoomEventHandler( this,
475
+ &Form1::MyZoomEvent );
476
+
477
+ // Size the control to fit the window
478
+ SetSize();
479
+
480
+ // Tell ZedGraph to calculate the axis ranges
481
+ // Note that you MUST call this after enabling IsAutoScrollRange, since AxisChange() sets
482
+ // up the proper scrolling parameters
483
+
484
+ z1->AxisChange();
485
+ // Make sure the Graph gets redrawn
486
+ z1->Invalidate();
487
+ timer1->Interval = this->chartobject_ptr->Get_update_time_chart();
488
+ timer1->Enabled = true;
489
+ timer1->Start();
490
+
491
+ tickStart = Environment::TickCount;
492
+ }
493
+ catch (...)
494
+ {
495
+ //unlock thread
496
+ int n = System::Threading::Interlocked::Exchange(this->chartobject_ptr->usingResource, 0);
497
+ assert(n == 2);
498
+ throw;
499
+ }
500
+
501
+ //unlock thread
502
+ int n = System::Threading::Interlocked::Exchange(this->chartobject_ptr->usingResource, 0);
503
+ assert(n == 2);
504
+ }
505
+
506
+ /// <summary>
507
+ /// Display customized tooltips when the mouse hovers over a point
508
+ /// </summary>
509
+ System::String ^MyPointValueHandler( ZedGraphControl ^control, GraphPane ^pane,
510
+ CurveItem ^curve, int iPt ) {
511
+ // Get the PointPair that is under the mouse
512
+ PointPair pt = curve[iPt];
513
+ return curve->Label->Text + " is " + pt.Y.ToString( "e3" ) + " units at X = " + pt.X.ToString( "e3" );
514
+ }
515
+
516
+ // Add some explanation to the menu..
517
+ void MyContextMenuBuilder( ZedGraphControl ^control,
518
+ System::Windows::Forms::ContextMenuStrip ^menuStrip,
519
+ Point mousePt,
520
+ ZedGraphControl::ContextMenuObjectState objState ) {
521
+
522
+ // removes Copy
523
+ menuStrip->Items->RemoveAt(0);
524
+ // removes Save Image As
525
+ menuStrip->Items->RemoveAt(0);
526
+
527
+ ToolStripMenuItem ^item = gcnew ToolStripMenuItem();
528
+ item->Text = L"Zoom: left mouse + drag\nPan: middle mouse + drag";
529
+ menuStrip->Items->Insert(5, item );
530
+
531
+ ToolStripMenuItem ^item3 = gcnew ToolStripMenuItem();
532
+ item3->Text = L"Chart options...";
533
+ item3->Click += gcnew System::EventHandler(this, &zdg_ui2::Form1::SetChartOptions );
534
+ menuStrip->Items->Insert(0, item3 );
535
+
536
+ //ToolStripMenuItem ^item5 = gcnew ToolStripMenuItem();
537
+ //item5->Text = L"Toggle Hints";
538
+ //item5->Click += gcnew System::EventHandler(this, &zdg_ui2::Form1::ToggleHints );
539
+ //menuStrip->Items->Insert(0, item5 );
540
+
541
+ ToolStripMenuItem ^item2 = gcnew ToolStripMenuItem();
542
+ item2->Text = L"Save Data to File...";
543
+ item2->Click += gcnew System::EventHandler(this, &zdg_ui2::Form1::SaveCurves );
544
+ menuStrip->Items->Insert(0, item2 );
545
+
546
+ ToolStripMenuItem ^item4 = gcnew ToolStripMenuItem();
547
+ item4->Text = L"Save Image As...";
548
+ item4->Click += gcnew System::EventHandler(this, &zdg_ui2::Form1::SaveImage );
549
+ menuStrip->Items->Insert(0, item4 );
550
+
551
+ }
552
+
553
+ void form_error_msg( std::string estring )
554
+ {
555
+ if (this->chartobject_ptr != NULL)
556
+ {
557
+ if (Phreeqc* ptr = this->chartobject_ptr->Get_phreeqc())
558
+ {
559
+ ptr->error_msg(estring.c_str(), CONTINUE);
560
+ }
561
+ }
562
+ else
563
+ {
564
+ std::cerr << "ERROR: " << estring << std::endl;
565
+ }
566
+ }
567
+
568
+ void SaveCurves( System::Object ^sender, System::EventArgs ^e )
569
+ {
570
+ SaveFileDialog^ saveFileDialog1 = gcnew SaveFileDialog;
571
+ //TCHAR dir[MAX_PATH];
572
+ //::GetCurrentDirectory(MAX_PATH, dir);
573
+ //String ^d = gcnew String(dir);
574
+ //saveFileDialog1->InitialDirectory = d;
575
+ saveFileDialog1->FileName = "curves.u_g";
576
+ saveFileDialog1->Filter = "User graph files (*.u_g)|*.u_g|txt files (*.txt)|*.txt|All files (*.*)|*.*";
577
+ saveFileDialog1->FilterIndex = 1;
578
+ saveFileDialog1->RestoreDirectory = true;
579
+ #undef OK
580
+ if ( saveFileDialog1->ShowDialog() == System::Windows::Forms::DialogResult::OK )
581
+ {
582
+ std::string file_name;
583
+ ToString(saveFileDialog1->FileName, file_name);
584
+ std::ofstream f_out(file_name.c_str(), std::ifstream::out);
585
+
586
+ if (!f_out.is_open())
587
+ {
588
+ std::ostringstream estream;
589
+ estream << "Could not open file to save curves for USER_GRAPH " << file_name;
590
+ form_error_msg(estream.str());
591
+ return;
592
+ }
593
+
594
+ // write headings
595
+ size_t max_points = 0;
596
+ f_out.precision(4);
597
+ for (int i = 0; i < zg1->GraphPane->CurveList->Count; i++)
598
+ {
599
+ LineItem ^curve;
600
+ curve = (LineItem ^) zg1->GraphPane->CurveList[i];
601
+ // Get the PointPairList
602
+ IPointListEdit ^ip = (IPointListEdit^) curve->Points;
603
+
604
+ // Calculate max_points
605
+ if ((size_t) ip->Count > max_points)
606
+ max_points = ip->Count;
607
+
608
+ // write headers
609
+ std::string s_std;
610
+ ToString(curve->Label->Text, s_std);
611
+ f_out.width(12);
612
+ f_out << "x" << "\t";
613
+ f_out.width(12);
614
+ if (s_std.size() > 0)
615
+ {
616
+ f_out << s_std << "\t";
617
+ }
618
+ else
619
+ {
620
+ f_out << "y" << "\t";
621
+ }
622
+ }
623
+
624
+ f_out << std::endl;
625
+
626
+ // write data
627
+ size_t i2 = 0;
628
+ f_out << std::scientific;
629
+ f_out.precision(4);
630
+
631
+ while (i2 < max_points)
632
+ {
633
+ for (int i = 0; i < zg1->GraphPane->CurveList->Count; i++)
634
+ {
635
+ LineItem ^curve;
636
+ curve = (LineItem ^) zg1->GraphPane->CurveList[i];
637
+ // Get the PointPairList
638
+ IPointListEdit ^ip = (IPointListEdit^) curve->Points;
639
+ if (i2 < (size_t) ip->Count)
640
+ {
641
+ //double x = ip[i]->X;
642
+ f_out.width(12);
643
+ f_out << ip[(int) i2]->X << "\t";
644
+ f_out.width(12);
645
+ f_out << ip[(int) i2]->Y << "\t";
646
+ }
647
+ else if (i2 < max_points)
648
+ {
649
+ f_out.width(13);
650
+ f_out << "\t";
651
+ f_out.width(13);
652
+ f_out << "\t";
653
+ }
654
+ }
655
+ f_out << std::endl;
656
+ i2++;
657
+ }
658
+ f_out.close();
659
+
660
+
661
+ }
662
+ else
663
+ {
664
+ // no dialog
665
+ std::ostringstream estream;
666
+ estream << "Could not open dialog to save curves. ";
667
+ form_error_msg(estream.str());
668
+ return;
669
+ }
670
+ return;
671
+ }
672
+
673
+ // Respond to a Zoom Event
674
+ void MyZoomEvent( ZedGraphControl ^control, ZoomState ^oldState, ZoomState ^newState )
675
+ {
676
+ // Here we get notification every time the user zooms
677
+ }
678
+ void SetChartOptions( System::Object ^sender, System::EventArgs ^e )
679
+ {
680
+ // Create form
681
+ Form ^graphOptions = gcnew Form;
682
+ graphOptions->Text = "Chart options";
683
+ graphOptions->ShowIcon = false;
684
+ graphOptions->BringToFront();
685
+ graphOptions->MinimumSize = System::Drawing::Size(255, 230);
686
+ graphOptions->MaximumSize = System::Drawing::Size(255, 230);
687
+ graphOptions->Size = System::Drawing::Size(255, 230);
688
+ graphOptions->StartPosition = System::Windows::Forms::FormStartPosition::CenterParent;
689
+
690
+ // Check box for hints
691
+ CheckBox ^cb1 = gcnew CheckBox;
692
+ cb1->Appearance = Appearance::Normal;
693
+ cb1->ThreeState = false;
694
+ cb1->AutoCheck = true;
695
+ cb1->Location = System::Drawing::Point(5, 10);
696
+ if (this->hints)
697
+ {
698
+ cb1->CheckState = CheckState::Checked;
699
+ }
700
+ else
701
+ {
702
+ cb1->CheckState = CheckState::Unchecked;
703
+ }
704
+ cb1->Text = "Show hints";
705
+ cb1->Visible = true;
706
+ graphOptions->Controls->Add(cb1);
707
+
708
+ // Check box for background color
709
+ CheckBox ^cb2 = gcnew CheckBox;
710
+ cb2->Appearance = Appearance::Normal;
711
+ cb2->ThreeState = false;
712
+ cb2->AutoCheck = true;
713
+ cb2->Location = System::Drawing::Point(5, 60);
714
+
715
+ if (this->background)
716
+ {
717
+ cb2->CheckState = CheckState::Checked;
718
+ }
719
+ else
720
+ {
721
+ cb2->CheckState = CheckState::Unchecked;
722
+ }
723
+ cb2->Text = "Show colored background";
724
+ cb2->AutoSize = true;
725
+ cb2->Visible = true;
726
+ graphOptions->Controls->Add(cb2);
727
+
728
+ // checkbox for grid
729
+ CheckBox ^cb3 = gcnew CheckBox;
730
+ cb3->Appearance = Appearance::Normal;
731
+ cb3->ThreeState = false;
732
+ cb3->AutoCheck = true;
733
+ cb3->Location = System::Drawing::Point(5, 110);
734
+
735
+ if (this->grid)
736
+ {
737
+ cb3->CheckState = CheckState::Checked;
738
+ }
739
+ else
740
+ {
741
+ cb3->CheckState = CheckState::Unchecked;
742
+ }
743
+ cb3->Text = "Show grid lines";
744
+ cb3->Visible = true;
745
+ graphOptions->Controls->Add(cb3);
746
+
747
+ // done button for Form
748
+ Button^ button1 = gcnew Button;
749
+ button1->DialogResult = System::Windows::Forms::DialogResult::OK;
750
+ button1->Text = "Done";
751
+ button1->Location = System::Drawing::Point(75, 160);
752
+ graphOptions->Controls->Add(button1);
753
+ graphOptions->AcceptButton = button1;
754
+
755
+ // cancel button for Form
756
+ Button^ button2 = gcnew Button;
757
+ button2->DialogResult = System::Windows::Forms::DialogResult::Cancel;
758
+ button2->Text = "Cancel";
759
+ button2->Location = System::Drawing::Point(155, 160);
760
+ graphOptions->Controls->Add(button2);
761
+ graphOptions->CancelButton = button2;
762
+
763
+
764
+ if (graphOptions->ShowDialog() == System::Windows::Forms::DialogResult::OK)
765
+ {
766
+ this->hints = (cb1->CheckState == CheckState::Checked);
767
+ this->background = (cb2->CheckState == CheckState::Checked);
768
+ this->grid = (cb3->CheckState == CheckState::Checked);
769
+ }
770
+
771
+ if (this->background)
772
+ {
773
+ zg1->GraphPane->Chart->Fill = gcnew Fill( Color::White, Color::FromArgb(255, 255, 230), 45.0f );
774
+ }
775
+ else
776
+ {
777
+ zg1->GraphPane->Chart->Fill = gcnew Fill( Color::White, Color::White, 45.0f );
778
+ }
779
+ if (this->grid)
780
+ {
781
+ zg1->GraphPane->XAxis->MajorGrid->IsVisible = true;
782
+ zg1->GraphPane->YAxis->MajorGrid->IsVisible = true;
783
+ }
784
+ else
785
+ {
786
+ zg1->GraphPane->XAxis->MajorGrid->IsVisible = false;
787
+ zg1->GraphPane->YAxis->MajorGrid->IsVisible = false;
788
+ }
789
+ if (this->hints)
790
+ {
791
+ zg1->GraphPane->GraphObjList = GOL_hints;
792
+ }
793
+ else
794
+ {
795
+ zg1->GraphPane->GraphObjList = GOL_no_hints;
796
+ }
797
+ zg1->Refresh();
798
+ }
799
+ void SaveImage( System::Object ^sender, System::EventArgs ^e )
800
+ {
801
+ ZedGraph::GraphObjList ^copy = gcnew ZedGraph::GraphObjList(zg1->GraphPane->GraphObjList);
802
+ zg1->GraphPane->GraphObjList = GOL_no_hints;
803
+ zg1->SaveAs();
804
+ zg1->GraphPane->GraphObjList = copy;
805
+ }
806
+ void BatchSaveImage( )
807
+ {
808
+ ChartObject *chart = this->chartobject_ptr;
809
+ assert(chart->Get_batch() > 0);
810
+ // Save GraphObjList
811
+ ZedGraph::GraphObjList ^GOL_copy = gcnew ZedGraph::GraphObjList(zg1->GraphPane->GraphObjList);
812
+
813
+ // Don`t write red hint boxes
814
+ zg1->GraphPane->GraphObjList = GOL_no_hints;
815
+
816
+ // Set background
817
+ if (chart->Get_batch_background())
818
+ {
819
+ zg1->GraphPane->Chart->Fill = gcnew Fill( Color::White, Color::FromArgb(255, 255, 230), 45.0f );
820
+ }
821
+ else
822
+ {
823
+ zg1->GraphPane->Chart->Fill = gcnew Fill( Color::White, Color::White, 45.0f );
824
+ }
825
+ // Set grid
826
+ if (chart->Get_batch_grid())
827
+ {
828
+ zg1->GraphPane->XAxis->MajorGrid->IsVisible = true;
829
+ zg1->GraphPane->YAxis->MajorGrid->IsVisible = true;
830
+ }
831
+ else
832
+ {
833
+ zg1->GraphPane->XAxis->MajorGrid->IsVisible = false;
834
+ zg1->GraphPane->YAxis->MajorGrid->IsVisible = false;
835
+ }
836
+ // Save the graph
837
+ if (this->zg1)
838
+ {
839
+ ImageFormat ^format = ImageFormat::Png;
840
+ switch (chart->Get_batch())
841
+ {
842
+ case 2:
843
+ format = ImageFormat::Png;
844
+ break;
845
+ case 3:
846
+ format = ImageFormat::Gif;
847
+ break;
848
+ case 4:
849
+ format = ImageFormat::Jpeg;
850
+ break;
851
+ case 5:
852
+ format = ImageFormat::Tiff;
853
+ break;
854
+ case 6:
855
+ format = ImageFormat::Bmp;
856
+ break;
857
+ default:
858
+ break;
859
+ }
860
+ switch (chart->Get_batch())
861
+ {
862
+ case 1: // emf
863
+ {
864
+ System::String ^fn = gcnew System::String(chart->Get_batch_fn().c_str());
865
+ System::Drawing::Imaging::Metafile ^metaFile = this->zg1->MasterPane->GetMetafile();
866
+ metaFile->Save(fn);
867
+ }
868
+ break;
869
+ case 2: // bitmaps
870
+ case 3:
871
+ case 4:
872
+ case 5:
873
+ case 6:
874
+ {
875
+ System::String ^fn = gcnew System::String(chart->Get_batch_fn().c_str());
876
+ System::IO::FileStream ^myStream = gcnew System::IO::FileStream(fn, System::IO::FileMode::Create);
877
+ zg1->MasterPane->GetImage()->Save( myStream, format);
878
+ myStream->Close();
879
+ }
880
+ default:
881
+ break;
882
+ }
883
+ }
884
+
885
+ }
886
+ private: void timer1_Tick(System::Object ^sender, System::EventArgs ^e )
887
+ {
888
+ LineItem ^curve;
889
+ ChartObject *chart = this->chartobject_ptr;
890
+ if (chart == NULL) return;
891
+
892
+ //lock for thread
893
+ while (0 != System::Threading::Interlocked::CompareExchange(chart->usingResource, 3, 0))
894
+ {
895
+ System::Threading::Thread::Sleep(5);
896
+ }
897
+
898
+ try
899
+ {
900
+ if (this->chartobject_ptr->Get_curve_added())
901
+ {
902
+ DefineCurves(zg1->GraphPane, zg1->GraphPane->CurveList->Count);
903
+ }
904
+ else if (this->chartobject_ptr->Get_point_added())
905
+ {
906
+
907
+ // Make list of curves
908
+ std::vector<CurveObject *> Curves;
909
+ size_t j;
910
+ for (j = 0; j < chart->Get_CurvesCSV().size(); j++)
911
+ {
912
+ Curves.push_back(chart->Get_CurvesCSV()[j]);
913
+ }
914
+ for (j = 0; j < chart->Get_Curves().size(); j++)
915
+ {
916
+ Curves.push_back(chart->Get_Curves()[j]);
917
+ }
918
+ // Add points to curves ...
919
+ for (int i = 0; i < zg1->GraphPane->CurveList->Count; i++)
920
+ {
921
+ curve = (LineItem ^) zg1->GraphPane->CurveList[i];
922
+ // Get the PointPairList
923
+ IPointListEdit ^ip = (IPointListEdit^) curve->Points;
924
+ if ((size_t) ip->Count < Curves[i]->Get_x().size())
925
+ {
926
+ if (Curves[i]->Get_y_axis() == 2)
927
+ Y2 = true;
928
+ else
929
+ Y2 = false;
930
+ for ( size_t i2 = ip->Count; i2 < Curves[i]->Get_x().size(); i2++ )
931
+ {
932
+ if ((LogX && Curves[i]->Get_x()[i2] <=0)
933
+ || (LogY && !Y2 && Curves[i]->Get_y()[i2] <=0)
934
+ || (LogY2 && Y2 && Curves[i]->Get_y()[i2] <=0))
935
+ continue;
936
+ else
937
+ ip->Add(Curves[i]->Get_x()[i2], Curves[i]->Get_y()[i2] );
938
+ }
939
+ }
940
+ }
941
+ // Add points to curves ...
942
+
943
+ //size_t i, k;
944
+ //k = 0;
945
+ //for (i = 0; i < Curves.size(); i++)
946
+ //{
947
+ // if (Curves[i]->Get_x().size() == 0) continue;
948
+ // curve = (LineItem ^) zg1->GraphPane->CurveList[k++];
949
+ // // Get the PointPairList
950
+ // IPointListEdit ^ip = (IPointListEdit^) curve->Points;
951
+ // if ((size_t) ip->Count < Curves[i]->Get_x().size())
952
+ // {
953
+ // if (Curves[i]->Get_y_axis() == 2)
954
+ // Y2 = true;
955
+ // else
956
+ // Y2 = false;
957
+ // for ( size_t i2 = ip->Count; i2 < Curves[i]->Get_x().size(); i2++ )
958
+ // {
959
+ // if ((LogX && Curves[i]->Get_x()[i2] <=0)
960
+ // || (LogY && !Y2 && Curves[i]->Get_y()[i2] <=0)
961
+ // || (LogY2 && Y2 && Curves[i]->Get_y()[i2] <=0))
962
+ // continue;
963
+ // else
964
+ // ip->Add(Curves[i]->Get_x()[i2], Curves[i]->Get_y()[i2] );
965
+ // }
966
+ // }
967
+ //}
968
+ /* explicitly reset the max in case of log scale, zedgraphs doesn`t do this... */
969
+ if ((fabs(chart->Get_axis_scale_x()[1] - NA) < 1e-3) && zg1->GraphPane->XAxis->Type == AxisType::Log)
970
+ {
971
+ double max = -1e99;
972
+ for (int i = 0; i < zg1->GraphPane->CurveList->Count; i++)
973
+ {
974
+ if (Curves[i]->Get_x().size() > 0)
975
+ {
976
+ if (Curves[i]->Get_x()[Curves[i]->Get_x().size() - 1] > max)
977
+ max = Curves[i]->Get_x()[Curves[i]->Get_x().size() - 1];
978
+ }
979
+ }
980
+ if (max > 0)
981
+ {
982
+ max += pow(10.0, log10(max / 3));
983
+ }
984
+ else
985
+ {
986
+ zg1->GraphPane->XAxis->Scale->Min = 0;
987
+ max = zg1->GraphPane->XAxis->Scale->Min + 1.0;
988
+ }
989
+ zg1->GraphPane->XAxis->Scale->Max = max;
990
+ }
991
+ if ((fabs(chart->Get_axis_scale_y()[1] - NA) < 1e-3) && zg1->GraphPane->YAxis->Type == AxisType::Log)
992
+ {
993
+ double max = -1e99;
994
+ for (int i = 0; i < zg1->GraphPane->CurveList->Count; i++)
995
+ {
996
+ curve = (LineItem^)zg1->GraphPane->CurveList[i];
997
+ if (curve->IsY2Axis) continue;
998
+ if (Curves[i]->Get_y().size() > 0)
999
+ {
1000
+ if (Curves[i]->Get_y()[Curves[i]->Get_y().size() - 1] > max)
1001
+ max = Curves[i]->Get_y()[Curves[i]->Get_y().size() - 1];
1002
+ }
1003
+ }
1004
+ if (max > 0)
1005
+ {
1006
+ max += pow(10.0, log10(max / 3));
1007
+ }
1008
+ else
1009
+ {
1010
+ zg1->GraphPane->YAxis->Scale->Min = 0;
1011
+ max = zg1->GraphPane->YAxis->Scale->Min + 1.0;
1012
+ }
1013
+ zg1->GraphPane->YAxis->Scale->Max = max;
1014
+ }
1015
+ if ((fabs(chart->Get_axis_scale_y2()[1] - NA) < 1e-3) && zg1->GraphPane->Y2Axis->Type == AxisType::Log)
1016
+ {
1017
+ double max = -1e99;
1018
+ for (int i = 0; i < zg1->GraphPane->CurveList->Count; i++)
1019
+ {
1020
+ curve = (LineItem^)zg1->GraphPane->CurveList[i];
1021
+ if (!curve->IsY2Axis) continue;
1022
+ if (Curves[i]->Get_y().size() > 0)
1023
+ {
1024
+ if (Curves[i]->Get_y()[Curves[i]->Get_y().size() - 1] > max)
1025
+ max = Curves[i]->Get_y()[Curves[i]->Get_y().size() - 1];
1026
+ }
1027
+ }
1028
+ if (max > 0.0)
1029
+ {
1030
+ max += pow(10.0, log10(max / 3));
1031
+ }
1032
+ else
1033
+ {
1034
+ zg1->GraphPane->Y2Axis->Scale->Min = 0;
1035
+ max = zg1->GraphPane->Y2Axis->Scale->Min + 1.0;
1036
+ }
1037
+ zg1->GraphPane->Y2Axis->Scale->Max = max;
1038
+ }
1039
+ zg1->AxisChange();
1040
+ zg1->Refresh();
1041
+ }
1042
+ //
1043
+ // Following asserts may not be true for Log scales
1044
+ // negative values are rejected, so chart may have fewer points than phreeqc
1045
+ //
1046
+ //for (size_t j = 0; j < chart->Get_CurvesCSV().size(); j++)
1047
+ //{
1048
+ // if (zg1->GraphPane->CurveList[j]->Points->Count != chart->Get_CurvesCSV()[j]->Get_x().size())
1049
+ // {
1050
+ // fprintf(stderr, "graph points = %d\n", zg1->GraphPane->CurveList[j]->Points->Count);
1051
+ // fprintf(stderr, "phreeqc points = %d\n", chart->Get_CurvesCSV()[j]->Get_x().size());
1052
+ // }
1053
+ // assert(zg1->GraphPane->CurveList[j]->Points->Count == chart->Get_CurvesCSV()[j]->Get_x().size());
1054
+ //}
1055
+ //for (int j = chart->Get_CurvesCSV().size(); j < zg1->GraphPane->CurveList->Count; j++)
1056
+ //{
1057
+ // int k = j - chart->Get_CurvesCSV().size();
1058
+ // if (zg1->GraphPane->CurveList[j]->Points->Count != chart->Get_Curves()[k]->Get_x().size())
1059
+ // {
1060
+ // fprintf(stderr, "%d %d graph points = %d\n", j, k, zg1->GraphPane->CurveList[j]->Points->Count);
1061
+ // fprintf(stderr, "phreeqc points = %d\n", chart->Get_Curves()[k]->Get_x().size());
1062
+ // }
1063
+ // assert(zg1->GraphPane->CurveList[j]->Points->Count == chart->Get_Curves()[k]->Get_x().size());
1064
+ //}
1065
+ chart->Set_point_added(false);
1066
+ if (chart->Get_end_timer())
1067
+ {
1068
+ timer1->Stop();
1069
+ chart->Set_done(true);
1070
+ phreeqc_done = true;
1071
+
1072
+ int batch = chart->Get_batch();
1073
+ if (batch > 0)
1074
+ {
1075
+ BatchSaveImage();
1076
+ }
1077
+
1078
+ //unlock thread before setting chartobject_ptr to NULL
1079
+ int n = System::Threading::Interlocked::Exchange(this->chartobject_ptr->usingResource, 0);
1080
+ assert(n == 3);
1081
+
1082
+ //this->phreeqc_ptr = NULL;
1083
+ this->chartobject_ptr = NULL;
1084
+ if (batch >= 0)
1085
+ {
1086
+ this->Close();
1087
+ }
1088
+ return;
1089
+ }
1090
+ }
1091
+ catch(...)
1092
+ {
1093
+ int n = System::Threading::Interlocked::Exchange(this->chartobject_ptr->usingResource, 0);
1094
+ assert(n == 3);
1095
+
1096
+ throw;
1097
+ }
1098
+
1099
+ //unlock thread
1100
+ int n = System::Threading::Interlocked::Exchange(this->chartobject_ptr->usingResource, 0);
1101
+ assert(n == 3);
1102
+ //tickStart = Environment::TickCount;
1103
+ return;
1104
+ }
1105
+
1106
+ void ToString(System::String^ src, std::string& dest)
1107
+ {
1108
+ using namespace System::Runtime::InteropServices;
1109
+ const char* chars = (const char*)(Marshal::StringToHGlobalAnsi(src)).ToPointer();
1110
+ dest = chars;
1111
+ Marshal::FreeHGlobal(IntPtr((void*)chars));
1112
+ }
1113
+ ~Form1() {
1114
+ if (this->zg1) delete zg1;
1115
+ //if (this->timer1) delete timer1);
1116
+ if (components) {
1117
+ delete components;
1118
+ }
1119
+ }
1120
+ public: ZedGraph::ZedGraphControl ^zg1;
1121
+ private: System::Windows::Forms::Timer ^timer1;
1122
+ private: System::ComponentModel::Container ^components;
1123
+ ChartObject * chartobject_ptr;
1124
+
1125
+ public:
1126
+ #pragma region Windows Form Designer generated code
1127
+ /// <summary>
1128
+ /// Required method for Designer support - do not modify
1129
+ /// the contents of this method with the code editor.
1130
+ /// </summary>
1131
+ void InitializeComponent()
1132
+ {
1133
+ //System::Threading::Thread::Sleep(5000);
1134
+ this->components = (gcnew System::ComponentModel::Container());
1135
+ this->zg1 = (gcnew ZedGraph::ZedGraphControl());
1136
+ this->timer1 = (gcnew System::Windows::Forms::Timer( this->components ));
1137
+ this->SuspendLayout();
1138
+ //
1139
+ // zg1
1140
+ //
1141
+ this->zg1->Location = System::Drawing::Point(12, 12);
1142
+ this->zg1->Name = L"zg1";
1143
+ this->zg1->ScrollGrace = 0;
1144
+ this->zg1->ScrollMaxX = 0;
1145
+ this->zg1->ScrollMaxY = 0;
1146
+ this->zg1->ScrollMaxY2 = 0;
1147
+ this->zg1->ScrollMinX = 0;
1148
+ this->zg1->ScrollMinY = 0;
1149
+ this->zg1->ScrollMinY2 = 0;
1150
+ this->zg1->Size = System::Drawing::Size(this->chartobject_ptr->Get_PanelWidth() - 2 * 12, chartobject_ptr->Get_PanelHeight() - 2 * 12);
1151
+ this->zg1->TabIndex = 0;
1152
+ this->timer1->Tick += gcnew System::EventHandler( this, &Form1::timer1_Tick );
1153
+ //
1154
+ // Form1
1155
+ //
1156
+ this->AutoScaleDimensions = System::Drawing::SizeF(6, 13);
1157
+ this->AutoScaleMode = System::Windows::Forms::AutoScaleMode::Font;
1158
+ this->AutoValidate = System::Windows::Forms::AutoValidate::EnablePreventFocusChange;
1159
+ this->ClientSize = System::Drawing::Size(this->chartobject_ptr->Get_PanelWidth(), chartobject_ptr->Get_PanelHeight());
1160
+ this->Controls->Add(this->zg1);
1161
+ this->Name = L"Form1";
1162
+ this->StartPosition = System::Windows::Forms::FormStartPosition::WindowsDefaultLocation;//:CenterScreen;
1163
+ //this->Text = L"PHREEQC chart";
1164
+ System::String ^desc = gcnew String(this->chartobject_ptr->Get_description().c_str());
1165
+ this->Text = L"Phreeqc USER_GRAPH " + this->chartobject_ptr->Get_n_user() + " " + desc;
1166
+ this->TopMost = false;
1167
+ System::ComponentModel::ComponentResourceManager^ resources = (gcnew System::ComponentModel::ComponentResourceManager(Form1::typeid));
1168
+ try
1169
+ {
1170
+ //this->Icon = gcnew System::Drawing::Icon("c:\\phreeqc\\phreex.ico");
1171
+ this->Icon = (cli::safe_cast<System::Drawing::Icon^>(resources->GetObject(L"$this.Icon")));
1172
+ }
1173
+ catch (...)
1174
+ {
1175
+ }
1176
+
1177
+ this->FormClosing += gcnew System::Windows::Forms::FormClosingEventHandler(this, &Form1::MyFormClosingEventHandler);
1178
+ this->Load += gcnew System::EventHandler(this, &Form1::Form1_Load);
1179
+ this->Resize += gcnew System::EventHandler(this, &Form1::Form1_Resize);
1180
+ this->ResumeLayout(false);
1181
+ }
1182
+ #pragma endregion
1183
+ };
1184
+ }