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freebsd-ports/science/cdk/pkg-descr
Stefan Eßer fb16dfecae Remove WWW entries moved into port Makefiles
Commit b7f05445c0 has added WWW entries to port Makefiles based on
WWW: lines in pkg-descr files.

This commit removes the WWW: lines of moved-over URLs from these
pkg-descr files.

Approved by:		portmgr (tcberner)
2022-09-07 23:58:51 +02:00

12 lines
553 B
Plaintext

The CDK is an open-source Java software for cheminformatics and bioinformatics.
Key Features:
* Molecule and reaction valence bond representation.
* Read and write file formats: SMILES, SDF, InChI, Mol2, CML, and others.
* Efficient molecule processing algorithms: Ring Finding, Kekulisation, Aromaticity.
* Coordinate generation and rendering.
* Canonical identifiers for fast exact searching.
* Substructure and SMARTS pattern searching.
* ECFP, Daylight, MACCS, and other fingerprint methods for similarity searching.
* QSAR descriptor calculations