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Pull requests: FelixBaensch/MORTAR

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Pull requests list

Updates CDK from 2.9 to 2.10 and replaces SRU and EFGF artifacts with the new CDK-own implementations
#158 opened Jan 10, 2025 by JonasSchaub • Draft
@JonasSchaub
2
Integration/implementation of RECAP algorithm enhancement New feature or request
#143 opened Nov 15, 2024 by JonasSchaub • Draft MORTAR v2.0.0
@JonasSchaub
2
Fingerprints and clustering integration new attempt enhancement New feature or request
#141 opened Nov 14, 2024 by JonasSchaub • Draft MORTAR v2.0.0
@JonasSchaub
Integration of CDK ExhaustiveFragmenter enhancement New feature or request
#133 opened Oct 7, 2024 by JonasSchaub Loading… MORTAR v2.0.0
@ToLeWeiss
32
Integration fingerprints and clustering enhancement New feature or request
#19 opened Dec 6, 2023 by JonasSchaub • Draft
@JonasSchaub
14
AlkylStructureFragmenter Implementation enhancement New feature or request
#10 opened Jul 7, 2023 by Mila1004 • Draft MORTAR v2.0.0
@Mila1004
263
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