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Add support of R-groups to the CDX loader. #36 #946

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merged 2 commits into from
Dec 22, 2022

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@even1024 even1024 merged commit 71d0374 into release/1.9 Dec 22, 2022
@even1024 even1024 deleted the bugfix/36-cdx-loader-rgroups branch December 22, 2022 09:28
even1024 added a commit that referenced this pull request Dec 23, 2022
…943 (#952)

* rgroups (#946)

Co-authored-by: Roman Porozhnetov <roman_porozhnetov@epam.com>

* CDX import: Reaction arrows disappear when opening a file #943 (#948)

* marvin cdx fix

* clang fix

Co-authored-by: Roman Porozhnetov <roman_porozhnetov@epam.com>

Co-authored-by: Roman Porozhnetov <roman_porozhnetov@epam.com>
even1024 added a commit that referenced this pull request Dec 26, 2022
* rgroups (#946)

Co-authored-by: Roman Porozhnetov <roman_porozhnetov@epam.com>

* CDX import: Reaction arrows disappear when opening a file #943 (#948)

* marvin cdx fix

* clang fix

Co-authored-by: Roman Porozhnetov <roman_porozhnetov@epam.com>

* CDX import: Aromatized structures are not recognized when Pasting from Clipboard #950 (#953)

* bond order fix

* clang fix

* test fix

Co-authored-by: Roman Porozhnetov <roman_porozhnetov@epam.com>

Co-authored-by: Roman Porozhnetov <roman_porozhnetov@epam.com>
loimu pushed a commit that referenced this pull request Jan 17, 2023
…943 (#952)

* rgroups (#946)

Co-authored-by: Roman Porozhnetov <roman_porozhnetov@epam.com>

* CDX import: Reaction arrows disappear when opening a file #943 (#948)

* marvin cdx fix

* clang fix

Co-authored-by: Roman Porozhnetov <roman_porozhnetov@epam.com>

Co-authored-by: Roman Porozhnetov <roman_porozhnetov@epam.com>
loimu pushed a commit that referenced this pull request Jan 17, 2023
* rgroups (#946)

Co-authored-by: Roman Porozhnetov <roman_porozhnetov@epam.com>

* CDX import: Reaction arrows disappear when opening a file #943 (#948)

* marvin cdx fix

* clang fix

Co-authored-by: Roman Porozhnetov <roman_porozhnetov@epam.com>

* CDX import: Aromatized structures are not recognized when Pasting from Clipboard #950 (#953)

* bond order fix

* clang fix

* test fix

Co-authored-by: Roman Porozhnetov <roman_porozhnetov@epam.com>

Co-authored-by: Roman Porozhnetov <roman_porozhnetov@epam.com>
even1024 added a commit that referenced this pull request Jan 30, 2023
* rgroups (#946)

Co-authored-by: Roman Porozhnetov <roman_porozhnetov@epam.com>

* CDX import: Reaction arrows disappear when opening a file #943 (#948)

* marvin cdx fix

* clang fix

Co-authored-by: Roman Porozhnetov <roman_porozhnetov@epam.com>

* bond order fix

* clang fix

* test fix

* cdx export

* clang fixes

* cdx python binding

* clang fixes

* api fixes

* cdx export

* indigo py fix

* cdx

* cdx

* cdx fixes

* clang fix

* PR comments

* clang fix

* pr fix

* pr fix

* b64cdx java&dotnet fix

* b64cdx java&dotnet fix

* b64cdx java&dotnet fix

* diff fix

* test fix

* clang fix

* mol_to_cdx.out deleted

* clang fix

* tests fix

* tests fix

* tests fix

* tests fix

* tests fix

* tests fix

* tests fix

* tests fix

---------

Co-authored-by: Roman Porozhnetov <roman_porozhnetov@epam.com>
even1024 added a commit that referenced this pull request Jan 30, 2023
* rgroups (#946)

Co-authored-by: Roman Porozhnetov <roman_porozhnetov@epam.com>

* CDX import: Reaction arrows disappear when opening a file #943 (#948)

* marvin cdx fix

* clang fix

Co-authored-by: Roman Porozhnetov <roman_porozhnetov@epam.com>

* bond order fix

* clang fix

* test fix

* cdx export

* clang fixes

* cdx python binding

* clang fixes

* api fixes

* cdx export

* indigo py fix

* cdx

* cdx

* cdx fixes

* clang fix

* PR comments

* clang fix

* pr fix

* pr fix

* b64cdx java&dotnet fix

* b64cdx java&dotnet fix

* b64cdx java&dotnet fix

* diff fix

* test fix

* clang fix

* mol_to_cdx.out deleted

* clang fix

* tests fix

* tests fix

* tests fix

* tests fix

* tests fix

* tests fix

* tests fix

* tests fix

* fix dir

* fix dir

* fix dir

---------

Co-authored-by: Roman Porozhnetov <roman_porozhnetov@epam.com>
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2 participants