Additional file 4 of QSAR-derived affinity fingerprints (part 1): fingerprint construction and modeling performance for similarity searching, bioactivity classification and scaffold hopping

Additional file 4. Scaffold hopping task. The list of targets used for scaffold hopping potential assessment, the number of ACSKs and RACSKs and the number of ACSKs retrieved using the Morgan2, b-QAFFP and rv-QAFFP fingerprints and the combination rv+b-QAFFP.

补充文件4：骨架跃迁任务（scaffold hopping task）。用于骨架跃迁潜力评估的靶点列表、ACSKs与RACSKs的数量，以及采用Morgan2、b-QAFFP、rv-QAFFP指纹及rv+b-QAFFP组合指纹检索得到的ACSKs数量。