 Adam Husar
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793c3dce5a
Added dump for individual molecule
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3 年之前 |
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Adam Husar
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f43346035e
Unified naming of 'rxn', all previous variants that used just 'rx' were
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3 年之前 |
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Adam Husar
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fcf1427724
Changed license from GPL to MIT, removed some empty/unused files
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3 年之前 |
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Adam Husar
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8045ad6459
Removed invalid assert
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3 年之前 |
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Adam Husar
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e41133b50f
Renamed subpartition -> subpart
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3 年之前 |
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Adam Husar
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e7344c698d
Merged find_volume_mol_reactions_with_surf_classes and
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3 年之前 |
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Adam Husar
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15b5ffc428
Removed several old TODOs
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3 年之前 |
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Adam Husar
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637bd5640c
Support for counting of missed rxns, renamed FLT_GIGANTIC to
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3 年之前 |
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Adam Husar
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9bc7b8f86b
Moves species_id_t and other typedefs into the BNG namespace
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3 年之前 |
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Adam Husar
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af9b27b795
Replaced all uses of float_t with double
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3 年之前 |
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Adam Husar
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72c5c6e7e5
Using Partition.get_species instead of Partition.get_all_species.get
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3 年之前 |
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Adam Husar
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f78754177f
Renamed *Util namespaces to *Utils to make it consistent with file names
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3 年之前 |
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Adam Husar
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1c3f02a382
Support for a combination of unimol rxn and surf mol+surf class rxns
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3 年之前 |
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Adam Husar
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e5d4538082
Preparation for surface mol+surface class rxns
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3 年之前 |
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Adam Husar
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84a0ea8acd
Fixed handlign of orientation for vol+surf class rxns, preparation for
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3 年之前 |
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Adam Husar
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e03b951dee
Preparation for handling of restricted regions in
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3 年之前 |
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Adam Husar
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bb06fa93c1
Renamed .inc files to a more common extension .inl
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3 年之前 |
