HADDOCK membrane protein-protein complex models
收藏DataCite Commons2020-09-20 更新2025-04-15 收录
下载链接：
http://data.sbgrid.org/dataset/618
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资源简介：
Decoys of a membrane protein complex docking benchmark. The decoys were obtained after docking with the HADDOCK webserver (v2.2) and they belong in two sets which reflect two extreme docking scenarios. One where we would have no information about the nature of the interaction and we use random restraints to drive the docking, and one where we use restraints extracted from the interface of the native complex to drive the docking. We have generated 50800 structures for the first scenario, distributed in three stages: 50000, 400 and 400 for the rigid-body, simulated annealing and flexible refinement stages respectively. We have generated 10800 structures for the second scenario distributed in three stages: 10000, 400 and 400 for the rigid-body, simulated annealing and flexible refinement stages respectively.
提供机构：
SBGrid Data Bank
创建时间：
2018-10-29
