遇见数据集

Synapsin coarse-grained polymer melt simulation results

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Zenodo2026-04-14 更新2026-05-26 收录
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资源简介:

This dataset contains the simulation output bundle for a coarse-grained LAMMPS campaign on synapsin-inspired sticker-spacer polymers. It includes the full results/ tree available at bundle time, along with file-level integrity and reconstruction metadata for the archived split bundle. The archive is intended to preserve the complete simulation output state used for downstream inventory, phase-diagram analysis, and related figure-generation workflows. The bundle includes all runs present in results/ at the time of publication.Files: MANIFEST_SHA256.txt — SHA-256 per file under results/ (paths relative to PHY600 repo root). README_ZENODO.txt — staging notes. RECONSTRUCT_BUNDLE.txt — rejoin 25 binary parts into one results_bundle.tar.gz (5206855724 bytes). phy600_b200_aa … phy600_b200_ay — ~200MB fragments of one gzipped tar; concatenate in sorted order per RECONSTRUCT_BUNDLE.txt, then tar -xzf. PHY600 git: 10bd8d2dcd0d3a38898fcf3f3cb7c672335c7ace Archive split into ~200MB parts after large single-file uploads hit Zenodo gateway timeouts.

本数据集包含针对突触蛋白启发式贴纸-间隔物聚合物的粗粒度LAMMPS模拟任务的输出打包文件。该打包文件收录了打包时刻下results/目录内的完整结果目录树,同时附带针对该拆分归档打包文件的文件级完整性校验与重建元数据。 本归档文件旨在留存完整的模拟输出状态,以支撑下游数据集盘点、相图分析及相关图表生成等工作流。该打包文件包含论文发表时刻results/目录下的全部模拟运行结果。 文件说明: MANIFEST_SHA256.txt — 记录results/目录下所有文件的SHA-256哈希值,文件路径均相对于PHY600代码仓库根目录。 README_ZENODO.txt — 归档筹备说明文档。 RECONSTRUCT_BUNDLE.txt — 用于将25个二进制分块重新合并为results_bundle.tar.gz(文件大小为5206855724字节)的操作指南。 phy600_b200_aa … phy600_b200_ay — 单个gzip压缩tar包的约200MB分块文件,请按照RECONSTRUCT_BUNDLE.txt指定的排序顺序拼接后,执行tar -xzf命令完成解压。 PHY600 git提交哈希:10bd8d2dcd0d3a38898fcf3f3cb7c672335c7ace 因单个大文件上传触发Zenodo网关超时,本归档被拆分为约200MB的分块文件。

提供机构:
Zenodo
创建时间:
2026-04-13
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