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63e3ddba1", "name" : "demo-job", "labels" : [ "labelA", "labelB" ], "status" : "FINISHED", "type" : "OPTIMIZATION", "create_time"
5],标签名称长度为1~32,支持中文、字母、数字、空格、下划线和中划线,且不能以空格开头或者结尾。 - labelA - labelB timeout: 1440 # 流程超时时间,取值范围[1,144000],单位分钟,默认1440
总和以及与参考小分子的相似度来打分并进行排序。在初始化权重的基础上,每个约束所占的权重,会在每一轮的分子生成迭代中,根据所满足的约束来进行动态调整。比如说约束条件1,在分子生成迭代中比较容易满足,那么该条件的权重会降低,如果不容易满足,该条件的权重会升高。 如果需要设置官能团的约
5],单个标签最大长度32字符,支持中文、字母、数字、空格、下划线和中划线,且不能以空格开头或者结尾。 - labelA - labelB description: description # 作业描述,取值范围:输入字符最大长度为255
63e3ddba1", "name" : "demo-job", "labels" : [ "labelA", "labelB" ], "status" : "FINISHED", "type" : "ADMET", "create_time"
"AUTO", "job_description" : "description", "labels" : [ "labelA", "labelB" ], "priority" : 0, "timeout" : 1440, "output_dir" : "/job",
63e3ddba1", "name" : "demo-job", "labels" : [ "labelA", "labelB" ], "status" : "FINISHED", "type" : "POCKETDETECTION", "start_time"
5],标签名称长度为1~32,支持中文、字母、数字、空格、下划线和中划线,且不能以空格开头或者结尾。 - labelA - labelB image: 'gwj-test-01/busybox:latest' # docker镜像地址取值范围[1-255
"demo-job", "description" : "description", "labels" : [ "labelA", "labelB" ], "priority" : 0, "timeout" : 1440, "output_dir" : "/job/task"
5],单个标签最大长度32字符,支持中文、字母、数字、空格、下划线和中划线,且不能以空格开头或者结尾。 - labelA - labelB timeout: 1440 # 流程超时时间,取值范围[1,144000],单位分钟,默认1440
5],单个标签最大长度32字符,支持中文、字母、数字、空格、下划线和中划线,且不能以空格开头或者结尾。 - labelA - labelB image: 'gwj-test-01/busybox:latest' # docker镜像地址,取值范围[5-255],不能包含中文字符
e3ddba1", "name" : "demo-job", "labels" : [ "labelA", "labelB" ], "status" : "FINISHED", "type" : "OPTIMIZATION", "create_time"
63e3ddba1", "name" : "demo-job", "labels" : [ "labelA", "labelB" ], "status" : "FINISHED", "type" : "OPTIMIZATION", "create_time"
"summary", "description" : "description", "labels" : [ "labelA", "labelB" ], "timeout" : 1440, "output_dir" : "/workflow", "tasks" : [ {
"summary", "description" : "description", "labels" : [ "labelA", "labelB" ], "timeout" : 1440, "output_dir" : "/workflow", "tasks" : [ {
63e3ddba1", "name" : "demo-job", "labels" : [ "labelA", "labelB" ], "status" : "FINISHED", "type" : "POCKE_MOL_DESIGN", "start_time"
"summary", "description" : "description", "labels" : [ "labelA", "labelB" ], "image" : "gwj-test-01/busybox:latest", "commands" : [ "echo
63e3ddba1", "name" : "demo-job", "labels" : [ "labelA", "labelB" ], "status" : "FINISHED", "type" : "OPTIMIZATION", "create_time"
"summary", "description" : "description", "labels" : [ "labelA", "labelB" ], "image" : "gwj-test-01/busybox:latest", "commands" : [ "echo
"summary", "description" : "description", "labels" : [ "labelA", "labelB" ], "image" : "gwj-test-01/busybox:latest", "commands" : [ "echo