Shuettel7/mol2 import export#29
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mol2 import and export are now implemented only for MOLECULE, ATOM, and BOND sections. |
ToDo: tests have shown => need to make import more flexible
Signed-off-by: Samuel Hüttel <shuettel@students.uni-mainz.de>
Signed-off-by: Samuel Hüttel <shuettel@students.uni-mainz.de>
Signed-off-by: Samuel Hüttel <shuettel@students.uni-mainz.de>
Signed-off-by: Samuel Hüttel <shuettel@students.uni-mainz.de>
Signed-off-by: Samuel Hüttel <shuettel@students.uni-mainz.de>
Signed-off-by: Samuel Hüttel <shuettel@students.uni-mainz.de>
Signed-off-by: Samuel Hüttel <shuettel@students.uni-mainz.de>
Signed-off-by: Samuel Hüttel <shuettel@students.uni-mainz.de>
Signed-off-by: Samuel Hüttel <shuettel@students.uni-mainz.de>
Signed-off-by: Samuel Hüttel <shuettel@students.uni-mainz.de>
Signed-off-by: Samuel Hüttel <shuettel@students.uni-mainz.de>
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mol2 import and export implemented.
main use case in current state: converting json files for small molecules to mol2 SYBYL format