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SPONGE 分子模拟是指利用计算机以原子水平的分子模型来模拟分子结构与行为，进而模拟分子体系的各种物理、化学性质的方法。它是在实验基础上，通过基本原理，构筑起一套模型和算法，从而计算出合理的分子结构与分子行为。SPONGE（Simulation Package tOward Next G
SPONGE 分子模拟是指利用计算机以原子水平的分子模型来模拟分子结构与行为，进而模拟分子体系的各种物理、化学性质的方法。它是在实验基础上，通过基本原理，构筑起一套模型和算法，从而计算出合理的分子结构与分子行为。SPONGE（Simulation Package tOward Next G
流程参数列表文件，取值范围[0, 10M] 响应参数 无 请求示例 更新Nextflow流程，修改流程描述为description，标签为labelA,labelB，流程主文件为main.nf https://eihealth.cn-north-4.myhuaweicloud.com/v1/{proj
完整描述文本 labels: # 可选 # 标签 - labelA - labelB timeout: 1440 # 可选 # 流程超时时间，取值范围[1,144000]，单位分钟，默认1440
价配体与受体相互作用的好坏，并找到两个分子之间最佳的结合模式。由于分子对接考虑了受体结构的信息以及受体和药物分子之间的相互作用信息，因此从原理上讲，它比仅仅从配体结构出发的药物设计方法更加具有合理性。 Docking Summary流程由ligand-smiles-to-3dsd
完整描述文本 labels: # 可选 # 标签 - labelA - labelB image: 'xxxx' # 必选 # 镜像地址 commands:
project -d "详细描述" -s "简要描述" -o "/data/output" -t 2000 -l "labelA;labelB" # 返回结果如下 edit workflow succeed! 父主题： EIHealth流程管理命令
"summary", "description" : "description", "labels" : [ "labelA", "labelB" ], "create_time" : "2021-01-30T02:34:36Z", "update_time" :
"summary", "description" : "description", "labels" : [ "labelA", "labelB" ], "create_time" : "2021-01-30T02:34:36Z", "update_time" :
"demo-workflow", "description" : "description", "labels" : [ "labelA", "labelB" ], "create_time" : "2021-01-30T02:34:36Z", "update_time" :
app-name:version:srcproject -d "详细描述" -s "简要描述" -c "fastqc" -l "labelA;labelB" # 返回结果如下 edit app succeed! 父主题： 应用管理命令
"demo-job", "description" : "description", "labels" : "labelA,labelB", "workflow_id" : "caadcb56-5bb6-11eb-8a0d-fa163e3ddba1" } 响应示例 状态码：
"demo-workflow", "description" : "description", "labels" : "labelA,labelB", "workflow_file" : "(binary)", "main_file" : "main.nf" } 响应示例 状态码：
"demo-workflow", "description" : "description", "labels" : [ "labelA", "labelB" ], "create_time" : "2021-01-30T02:34:36Z", "update_time" : "2021-01-30T02:53:26Z"
"demo-job", "description" : "description", "labels" : [ "labelA", "labelB" ], "status" : "COMPLETED", "has_ignore_failed_tasks" : false,
63e3ddba1", "name" : "demo-job", "labels" : [ "labelA", "labelB" ], "status" : "FINISHED", "type" : "OPTIMIZATION", "create_time"
e3ddba1", "name" : "demo-job", "labels" : [ "labelA", "labelB" ], "status" : "FINISHED", "type" : "OPTIMIZATION", "create_time"
63e3ddba1", "name" : "demo-job", "labels" : [ "labelA", "labelB" ], "status" : "FINISHED", "type" : "SEARCH", "create_time"
e3ddba1", "name" : "demo-job", "labels" : [ "labelA", "labelB" ], "status" : "FINISHED", "type" : "CLUSTERING", "create_time"
"summary", "description" : "description", "labels" : [ "labelA", "labelB" ], "timeout" : 1440, "output_dir" : "/workflow", "tasks" : [ {
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