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lingyuzeng/vina_docking_batch
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lingyuzeng 0d1d542919 过滤在 karamadock 与 AutoDock vina 中聚类后前 1000 分子在 glide 对接的交集结果.(trpe 与 fgbar)
2025-08-20 22:01:46 +08:00
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filter_docking_and_dedupe.ipynb
过滤在 karamadock 与 AutoDock vina 中聚类后前 1000 分子在 glide 对接的交集结果.(trpe 与 fgbar)
2025-08-20 22:01:46 +08:00
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