lizhanyuan
9899d4a0c7
- 新增 avogadro/imagej/jade/origin/ovito/pymol/vesta 等科研软件任务 JSON - 修改 vllm_eval.py，修改图片文件名称为第x步 - desktop_env.py 添加额外数据参数 config 和 metadata
44 lines
930 B
JSON
44 lines
930 B
JSON
{
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"id": "building-organic-molecules_task4",
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"snapshot": "avogadro",
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"instruction": "在 Avogadro 2 中，为甲苯分子执行几何优化。",
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"source": "custom",
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"config": [
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{
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"type": "launch",
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"parameters": {
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"command": [
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"C:\\Avogadro2\\bin\\avogadro2.exe"
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]
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}
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},
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{
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"type": "sleep",
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"parameters": {
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"seconds": 5
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}
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}
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],
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"trajectory": "trajectories/",
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"related_apps": [
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"avogadro"
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],
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"evaluator": {
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"postconfig": [
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{
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"type": "sleep",
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"parameters": {
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"seconds": 3
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}
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}
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],
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"func": "vllm_eval"
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},
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"proxy": false,
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"fixed_ip": false,
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"possibility_of_env_change": "low",
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"metadata": {
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"input_files": [],
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"steps": "1. 按 Ctrl+Alt+O 或点击 Auto Optimize 工具执行几何优化。\n2. 检查分子是否获得合乎逻辑的几何结构。"
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}
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} |