There "should" not be any breaking change 2.2.1 -> 2.7.1. If there is try including the cdk-legacy module.
Best regards John On Tue, 19 Jul 2022 at 08:14, Uli Fechner <[email protected]> wrote: > Hi, > > I want to apply a SMIRKS pattern to a molecule and get the products as a > result. My understanding is that CDK does not support this at the moment. > Is that correct? > > The ambit-smirks package by IdeaConsult seems to offer the functionality I > am looking for. However, it declares a dependency on cdk 2.2.1 in its > latest pom ( > https://github.com/ideaconsult/ambit-mirror/blob/master/ambit2-all/pom.xml). > We use cdk 2.71 and I don't want to downgrade. Does anyone have any > experience with bumping the cdk version in ambit and compiling it yourself? > > Any help is much appreciated. > > Best > Uli > _______________________________________________ > Cdk-user mailing list > [email protected] > https://lists.sourceforge.net/lists/listinfo/cdk-user >
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