公开记录
软件健康报告模式 0.27.0 · 指标 1.13.0 · 2026-07-26 07:04 UTC

dralgroup / mlatom

AI-enhanced computational chemistry

Python · FortranApache-2.0★ 153 星标⑂ 21 复刻始于 2023年8月在 GitHub 上查看 ↗

dralgroup/mlatom 的健康指数为 100 分中的 56 分,处于「中等」区间。 其得分最高的类别是Vitality(75/100),最低的是AI Readiness(40/100)。 最近一次更新在 11 天前。 近期的大部分工作由 1 位贡献者完成。

56
总分 / 100
中等

软件健康指数

指标归入加权类别,统一采用 1–100 量表。总体分先取类别加权平均;当公开证据触发高风险司法辖区政策时,评级会按政策调整,并设置 49(有风险)的上限。AI 就绪度不计入总体分。

56
优秀85-100堪称典范;基本满足所有检验标准
良好70-84健康;仅有轻微不足
中等50-69可接受,但存在明显不足;建议进行审查
存在风险30-49存在重大薄弱环节;采用时应保持审慎
危急1-29问题严重(项目被弃置、仅有单一维护者、缺乏基本工程规范)
活力社区与采用可持续性与治理工程质量安全AI 就绪度

评分画像

每条轴代表一个类别。形状比平均值更重要——健康的对象会填满整个图形,而“一峰一谷”式画像意味着某一维度的优势正掩盖另一维度的风险。

所有权

70 关注者24 个公开仓库始于 2022年2月Xiamen University

该仓库由个人账户拥有。相较于组织支持的项目,单一所有者项目的延续性风险更高。

软件包生态系统

注册表软件包版本月下载量版本数最近发布
PyPImlatom指向其他仓库——不计分3.23.4-6011 天前

按类别列示的指标

活力

项目是否仍有生命——是否仍在编写代码,是否仍在发布版本?

75良好 · 占总体的 22%
评分方式
28.8/36推送新近度 — 最近一次推送于 11 天前
6.2/36提交节奏 — 52 周中有 9 周有提交
13.3/18提交量 — 最近一年 29 次提交
10/10OpenSSF Scorecard:Maintained — 14 commit(s) and 0 issue activity found in the last 90 days -- score normalized to 10
所用输入
commits_last_year29
human_commit_share1
days_since_last_push11
active_weeks_last_year9

发布纪律

100优秀
评分方式
27/27有发布版本 — 已发布 38 个发布版本
36/36发布时效 — 最近一次发布版本于 11 天前
27/27发布节奏 — 约每 0.1 天发布一次
0/10OpenSSF Scorecard:Signed-Releases — 无数据
所用输入
releases_count38
latest_release_tagv3.23.4
releases_from_tags
days_since_latest_release11
mean_days_between_releases0.1
已排除计分(无数据或不适用):OpenSSF Scorecard:Signed-Releases。 其余权重已重新归一化。

社区与采用

项目是否拥有用户、下载量与关注度,并具备欢迎贡献者参与的配置?

65中等 · 占总体的 18%

流行度与采用

48存在风险
评分方式
35.4/60星标 — 153 个星标
10.8/25复刻 — 21 个复刻
1.7/15关注者 — 3 位关注者
所用输入
forks21
stars153
watchers3
growth_stateunverified
growth_factor_pct100
growth_unverified_reasonno_history

社区健康

85优秀
评分方式
22.5/22.5README
22.5/22.5许可证 — 可识别的许可证(Apache-2.0)
18/18CONTRIBUTING 指南
13.5/13.5行为准则
0/7.2议题模板
0/6.3PR 模板
所用输入
has_readme
has_license
has_contributing
has_issue_template
has_code_of_conduct
has_pull_request_template

可持续性与治理

项目能否在其成员之外延续——巴士系数、响应能力、由谁支持,以及软件包的维护状况?

46存在风险 · 占总体的 24%
评分方式
9/54巴士系数 — 1 位贡献者贡献了半数提交
5.3/22.5提交分布 — 头号贡献者编写了 77% 的提交
5.4/13.5贡献者广度 — 4 位贡献者
3/10OpenSSF Scorecard:Contributors — project has 1 contributing companies or organizations -- score normalized to 3
所用输入
bus_factor1
contributors_sampled4
top_contributor_share0.766
评分方式
29.2/46.8议题解决 — 62% 的议题已关闭
36.3/38.3PR 接受 — 已裁定的 PR 中 38/40 已合并
3/15OpenSSF Scorecard:Code-Review — Found 6/24 approved changesets -- score normalized to 2
所用输入
merged_prs38
open_issues3
closed_issues5
issue_closed_ratio0.625
closed_unmerged_prs2
评分方式
10/30所有权背书 — 个人(用户)账户
0/20已验证域名 — 不适用于个人账户
13.3/25所有者影响力 — dralgroup 有 70 位关注者
19/25既往记录 — 24 个公开仓库,账户约 4 年
所用输入
followers70
owner_typeUser
is_verified
owner_logindralgroup
public_repos24
account_age_days1,620
已排除计分(无数据或不适用):已验证域名。 其余权重已重新归一化。

工程质量

基础的工程与文档实践是否到位?

44存在风险 · 占总体的 20%

工程实践

24危急
评分方式
24/24CI 工作流 — 1 个工作流
0/24存在测试
0/16Linter 配置
0/9.6Pre-commit 钩子
0/6.4.editorconfig
0/20OpenSSF Scorecard:CI-Tests — 0 out of 6 merged PRs checked by a CI test -- score normalized to 0
所用输入
has_ci
has_tests
has_editorconfig
has_linter_config
has_precommit_config

文档

75良好
评分方式
30/30README
0/25文档目录
15/15文档 / 主页站点 — http://mlatom.com
10/10仓库描述
10/10主题标签 — 11 个主题标签
10/10Wiki
所用输入
topicsartificial-intelligence, computational-chemistry, machine-learning, machine-learning-potential, quantum-chemistry, quantum-chemistry-programs, quantum-mechanics, deep-learning, kernel-method, kernel-ridge-regression, neural-network
has_wiki
homepagehttp://mlatom.com
has_readme
has_docs_dir
has_description

安全

可见的安全与供应链实践是否稳固,且不存在未解决的高风险司法辖区暴露?

49存在风险 · 占总体的 16%

安全态势

45存在风险
评分方式
3.8/7.5Binary-Artifacts — binaries present in source code
0/7.5Branch-Protection — 无数据
0/2.5CI-Tests — 0 out of 6 merged PRs checked by a CI test -- score normalized to 0
0/2.5CII-Best-Practices — no effort to earn an OpenSSF best practices badge detected
1.5/7.5Code-Review — Found 6/24 approved changesets -- score normalized to 2
0.8/2.5Contributors — project has 1 contributing companies or organizations -- score normalized to 3
10/10Dangerous-Workflow — no dangerous workflow patterns detected
0/7.5Dependency-Update-Tool — no update tool detected
0/5Fuzzing — project is not fuzzed
2.5/2.5许可证 — license file detected
7.5/7.5Maintained — 14 commit(s) and 0 issue activity found in the last 90 days -- score normalized to 10
0/5Packaging — 无数据
0/5Pinned-Dependencies — dependency not pinned by hash detected -- score normalized to 0
0/5SAST — SAST tool is not run on all commits -- score normalized to 0
5/5Security-Policy — security policy file detected
0/7.5Signed-Releases — 无数据
0/7.5Token-Permissions — detected GitHub workflow tokens with excessive permissions
7.5/7.5Vulnerabilities — 0 existing vulnerabilities detected
所用输入
sourceopenssf_scorecard
checks_evaluated15
scorecard_versionv5.5.0
checks_inconclusive3
scorecard_aggregate4.5
已排除计分(无数据或不适用):branch_protection, packaging, signed_releases。 其余权重已重新归一化。
评分方式
6.6/35直接依赖不含已知公告 — 2 个受影响:torch 2.1.2 (critical 9.8), setuptools 80.10.2 (moderate 6.1)
25/25间接依赖不含已知公告 — 没有间接依赖携带已知公告
32.1/40没有长期未处理的公告 — 1 个携带公告的软件包超过 90 天未处理;最早一条发布于 829 天前
所用输入
sourceosv
advisories30
affected_packages2
assessed_packages55
unassessed_packages0
affected_by_severitycritical 1, moderate 1
direct_affected_packages2
比对的是 pypi:mlatom@3.23.4 的运行时依赖闭包——安装已发布的软件包时真正被拉取进来的内容——共 55 个软件包。 未对可达性进行分析。

AI 就绪度

该仓库在多大程度上具备与 AI 编码代理协同开发与维护的条件?这是一枚独立的实验性徽章——权重为 0.0,因此单独呈现,不影响总体健康评分。

40存在风险 · 占总体的 0%
评分方式
45/45代理指令 — AGENTS.md
0/15机器可读文档(llms.txt)
20.3/40可读的提交历史 — 100 次人类提交中有 38 次说明了意图(结构化标题或解释性正文)
所用输入
has_llms_txt
legible_history_share0.38
agent_instruction_filesAGENTS.md
agent_instruction_max_bytes2,804
评分方式
18/18一条命令的引导启动 — mlatom/MLatomF_src/Makefile
0/22自动化测试
0/11Lint / 格式化配置
0/11静态类型检查
0/10可复现环境
0/10已体现的代理实践 — 最近 100 次提交中没有代理编写的提交
0/8自动化维护 — 未观察到自动依赖更新
0/10OpenSSF Scorecard:Pinned-Dependencies — dependency not pinned by hash detected -- score normalized to 0
所用输入
has_nix
has_tests
lockfiles
has_dockerfile
typed_language
bootstrap_filesmlatom/MLatomF_src/Makefile
has_devcontainer
has_linter_config
typecheck_configs
agent_commit_share0
toolchain_manifests
dependency_bot_commit_share0
评分方式
0/45可类型检查的代码 — Python,未配置类型检查
50.2/55可控的文件大小 — 采样的 103 个源文件中有 9 个超过 60KB
所用输入
primary_languagePython
largest_source_bytes195,102
source_files_sampled103
oversized_source_files9

关键数据

153GitHub 星标
4贡献者
29最近 12 个月提交数
11距最近推送天数
38发布版本数
1巴士系数(bus factor)
3开放议题
PyPI软件包生态系统数

数据采集警告

  • Star history unavailable: GitHub GraphQL error: Resource not accessible by personal access token
  • pypi package 'mlatom' points at a different repository (http://mlatom.com); excluded from ecosystem scoring

更多细节

Star 与 Fork 历史 0 ★ / 21 ⇿
0Star
21Fork

每颗 star 和每个 fork 的添加时间,来自 GitHub 并按天汇总。累计增长位于其构成来源——每日新增——的正上方,二者可相互对照:稳定的自然增长与短暂的突增形态截然不同。当这一差别可被衡量时,它会作为增长真实性予以报告。

048121620242122023-112025-032026-07

每个点涵盖 3 天。

OpenSSF Scorecard 4.5 / 10
4.5综合

来自开源项目 OpenSSF Scorecard 的独立、工具无关的安全评估。每项检查奖励的是安全实践本身,而非特定供应商的工具。Scorecard 无法判定的检查项标记为 不适用,并从安全评分中剔除(绝不按零分计)。Scorecard v5.5.0 · 2026-07-26 07:03 UTC

5Binary-Artifactsbinaries present in source code
不适用Branch-Protectioninternal error: error during branchesHandler.setup: internal error: some github tokens can't read classic branch protection rules: https://github.com/ossf/scorecard-action/blob/main/docs/authentication/fine-grained-auth-token.md
0CI-Tests0 out of 6 merged PRs checked by a CI test -- score normalized to 0
0CII-Best-Practicesno effort to earn an OpenSSF best practices badge detected
2Code-ReviewFound 6/24 approved changesets -- score normalized to 2
3Contributorsproject has 1 contributing companies or organizations -- score normalized to 3
10Dangerous-Workflowno dangerous workflow patterns detected
0Dependency-Update-Toolno update tool detected
0Fuzzingproject is not fuzzed
10Licenselicense file detected
10Maintained14 commit(s) and 0 issue activity found in the last 90 days -- score normalized to 10
不适用Packagingpackaging workflow not detected
0Pinned-Dependenciesdependency not pinned by hash detected -- score normalized to 0
0SASTSAST tool is not run on all commits -- score normalized to 0
10Security-Policysecurity policy file detected
不适用Signed-Releasesno releases found
0Token-Permissionsdetected GitHub workflow tokens with excessive permissions
10Vulnerabilities0 existing vulnerabilities detected
直接依赖 14
注册表软件包版本约束清单文件
PyPInumpy<2pyproject.toml
PyPIscipypyproject.toml
PyPIh5pypyproject.toml
PyPIpyh5mdpyproject.toml
PyPItorch==2.1.2pyproject.toml
PyPItorchani==2.2.3pyproject.toml
PyPIsetuptools<81pyproject.toml
PyPImatplotlibpyproject.toml
PyPIstatsmodelspyproject.toml
PyPItqdmpyproject.toml
PyPIjoblibpyproject.toml
PyPIrequestspyproject.toml
PyPIpsutilpyproject.toml
PyPIgeometricpyproject.toml
全部依赖 4

来自 GitHub 依赖图的完整解析依赖集合:4 个直接依赖与 0 个间接(传递)软件包。仓库提交锁文件时,传递闭包才是完整的。

注册表软件包版本关系
PyPInumpy直接
PyPIsetuptools直接
PyPItorch2.1.2直接
PyPItorchani2.2.3直接
依赖安全公告 2

安装 pypi:mlatom@3.23.4 会引入 55 个包(直接与传递):其中 2 个存在已知公告,2 个为直接依赖。

软件包版本关系严重程度公告数修复版本
torch2.1.2直接严重282.13.0
setuptools80.10.2直接283.0.0

公告表示依赖图中记录的版本落入某条公告的受影响范围。可达性未经分析,且依赖图包含开发与测试的版本固定——某项发现可能只涉及工具链而非交付的软件。

原始 JSON 报告 机器可读
{
  "data": {
    "repo": {
      "topics": [
        "artificial-intelligence",
        "computational-chemistry",
        "machine-learning",
        "machine-learning-potential",
        "quantum-chemistry",
        "quantum-chemistry-programs",
        "quantum-mechanics",
        "deep-learning",
        "kernel-method",
        "kernel-ridge-regression",
        "neural-network"
      ],
      "is_fork": false,
      "size_kb": 207535,
      "has_wiki": true,
      "homepage": "http://mlatom.com",
      "languages": {
        "C++": 2360,
        "Julia": 22288,
        "Shell": 982,
        "Python": 2163931,
        "Fortran": 478446,
        "Gnuplot": 174,
        "Makefile": 2507
      },
      "pushed_at": "2026-07-15T00:35:28Z",
      "created_at": "2023-08-16T13:47:48Z",
      "owner_type": "User",
      "updated_at": "2026-07-18T07:37:12Z",
      "description": "AI-enhanced computational chemistry",
      "is_archived": false,
      "is_disabled": false,
      "license_spdx": "Apache-2.0",
      "default_branch": "main",
      "license_spdx_raw": "Apache-2.0",
      "primary_language": "Python",
      "significant_languages": [
        "Python",
        "Fortran"
      ]
    },
    "owner": {
      "blog": "http://dr-dral.com",
      "name": "Pavlo O. Dral & group",
      "type": "User",
      "login": "dralgroup",
      "company": "Xiamen University",
      "location": "Xiamen, China",
      "followers": 70,
      "avatar_url": "https://avatars.githubusercontent.com/u/99856727?v=4",
      "created_at": "2022-02-17T03:54:20Z",
      "is_verified": null,
      "public_repos": 24,
      "account_age_days": 1620
    },
    "license": {
      "state": "standard",
      "spdx_id": "Apache-2.0",
      "raw_spdx": "Apache-2.0",
      "file_present": true,
      "scorecard_found": true,
      "profile_has_license": true
    },
    "activity": {
      "releases": [
        {
          "tag": "v3.23.4",
          "kind": "patch",
          "published_at": "2026-07-15T00:35:42Z"
        },
        {
          "tag": "v3.23.3",
          "kind": "patch",
          "published_at": "2026-07-14T08:12:46Z"
        },
        {
          "tag": "v3.23.2",
          "kind": "patch",
          "published_at": "2026-07-14T08:12:43Z"
        },
        {
          "tag": "v3.23.1",
          "kind": "patch",
          "published_at": "2026-07-14T08:12:41Z"
        },
        {
          "tag": "v3.23.0",
          "kind": "minor",
          "published_at": "2026-07-14T08:12:38Z"
        },
        {
          "tag": "v3.22.0",
          "kind": "minor",
          "published_at": "2026-07-14T08:12:35Z"
        },
        {
          "tag": "v3.21.0",
          "kind": "minor",
          "published_at": "2026-07-14T08:12:33Z"
        },
        {
          "tag": "v3.20.0",
          "kind": "minor",
          "published_at": "2026-07-14T08:12:30Z"
        },
        {
          "tag": "v3.19.1",
          "kind": "patch",
          "published_at": "2026-07-14T08:12:27Z"
        },
        {
          "tag": "v3.19.0",
          "kind": "minor",
          "published_at": "2026-07-14T08:12:25Z"
        },
        {
          "tag": "v3.18.3",
          "kind": "patch",
          "published_at": "2026-07-14T08:12:22Z"
        },
        {
          "tag": "v3.18.2",
          "kind": "patch",
          "published_at": "2026-07-14T08:12:19Z"
        },
        {
          "tag": "v3.18.1",
          "kind": "patch",
          "published_at": "2026-07-14T08:12:17Z"
        },
        {
          "tag": "v3.18.0",
          "kind": "minor",
          "published_at": "2026-07-14T08:12:14Z"
        },
        {
          "tag": "v3.17.3",
          "kind": "patch",
          "published_at": "2026-07-14T08:12:11Z"
        },
        {
          "tag": "v3.17.1",
          "kind": "patch",
          "published_at": "2026-07-14T08:12:09Z"
        },
        {
          "tag": "v3.16.2",
          "kind": "patch",
          "published_at": "2026-07-14T08:12:06Z"
        },
        {
          "tag": "v3.16.1",
          "kind": "patch",
          "published_at": "2026-07-14T08:12:03Z"
        },
        {
          "tag": "v3.16.0",
          "kind": "minor",
          "published_at": "2026-07-14T08:12:01Z"
        },
        {
          "tag": "v3.15.0",
          "kind": "minor",
          "published_at": "2026-07-14T08:11:58Z"
        },
        {
          "tag": "v3.14.0",
          "kind": "minor",
          "published_at": "2026-07-14T08:11:56Z"
        },
        {
          "tag": "v3.13.0",
          "kind": "minor",
          "published_at": "2026-07-14T08:11:53Z"
        },
        {
          "tag": "v3.12.0",
          "kind": "minor",
          "published_at": "2026-07-14T08:11:51Z"
        },
        {
          "tag": "v3.11.0",
          "kind": "minor",
          "published_at": "2026-07-14T08:11:48Z"
        },
        {
          "tag": "v3.10.1",
          "kind": "patch",
          "published_at": "2026-07-14T08:11:46Z"
        },
        {
          "tag": "v3.10.0",
          "kind": "minor",
          "published_at": "2026-07-14T08:11:43Z"
        },
        {
          "tag": "v3.9.0",
          "kind": "minor",
          "published_at": "2026-07-14T08:11:41Z"
        },
        {
          "tag": "v3.8.0",
          "kind": "minor",
          "published_at": "2026-07-14T08:11:38Z"
        },
        {
          "tag": "v3.7.1",
          "kind": "patch",
          "published_at": "2026-07-14T08:11:36Z"
        },
        {
          "tag": "v3.7.0",
          "kind": "minor",
          "published_at": "2026-07-14T08:11:33Z"
        },
        {
          "tag": "v3.6.0",
          "kind": "minor",
          "published_at": "2026-07-14T08:11:31Z"
        },
        {
          "tag": "v3.5.0",
          "kind": "minor",
          "published_at": "2026-07-14T08:11:28Z"
        },
        {
          "tag": "v3.4.0",
          "kind": "minor",
          "published_at": "2026-07-14T08:11:26Z"
        },
        {
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              {
                "key": "openssf_scorecard_signed_releases",
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                "max_points": 10
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            "key": "abandonment",
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              "days_since_last_human_commit_is_floor": false
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          }
        ],
        "description": "Is the project alive — is code being written and are releases shipping?"
      },
      {
        "key": "community",
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        "name": "Community & Adoption",
        "value": 65,
        "weight": 0.18,
        "metrics": [
          {
            "key": "popularity",
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                    "code": "stars",
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                "max_points": 60
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              {
                "key": "forks",
                "name": "Forks",
                "detail": "21 forks",
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                    "code": "forks",
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                "key": "watchers",
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            "key": "community_health",
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            "notes": [],
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                "details": [
                  {
                    "code": "license_standard",
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                  {
                    "code": "license_spdx",
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              {
                "key": "contributing_guide",
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              },
              {
                "key": "code_of_conduct",
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              {
                "key": "issue_template",
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            "notes": [],
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              "top_contributor_share": 0.766
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                "key": "bus_factor",
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              {
                "key": "commit_distribution",
                "name": "Commit distribution",
                "detail": "top contributor authored 77% of commits",
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                  {
                    "code": "top_contributor_share",
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                "key": "contributor_breadth",
                "name": "Contributor breadth",
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                    "code": "contributors_sampled",
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                "max_points": 13.5
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              {
                "key": "openssf_scorecard_contributors",
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                "max_points": 10
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          },
          {
            "key": "responsiveness",
            "band": "moderate",
            "name": "Issue & PR responsiveness",
            "note": null,
            "notes": [],
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            "inputs": {
              "merged_prs": 38,
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              "closed_issues": 5,
              "issue_closed_ratio": 0.625,
              "closed_unmerged_prs": 2
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                "key": "issue_resolution",
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                "points": 29.2,
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                  {
                    "code": "issues_closed_share",
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                      "share": 62
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                  }
                ],
                "max_points": 46.75
              },
              {
                "key": "pr_acceptance",
                "name": "PR acceptance",
                "detail": "38/40 decided PRs merged",
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                "status": "partial",
                "details": [
                  {
                    "code": "decided_prs_merged",
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                      "merged": 38,
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                  }
                ],
                "max_points": 38.25
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              {
                "key": "openssf_scorecard_code_review",
                "name": "OpenSSF Scorecard: Code-Review",
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                "points": 3,
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                "details": [],
                "max_points": 15
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            ]
          },
          {
            "key": "stewardship",
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            "name": "Ownership & stewardship",
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            "notes": [
              {
                "code": "excluded_no_data",
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                  "components": [
                    "verified_domain"
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              {
                "code": "weights_renormalized",
                "params": {}
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            "value": 53,
            "inputs": {
              "followers": 70,
              "owner_type": "User",
              "is_verified": null,
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              "public_repos": 24,
              "account_age_days": 1620
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            "components": [
              {
                "key": "ownership_backing",
                "name": "Ownership backing",
                "detail": "personal (user) account",
                "points": 10,
                "status": "partial",
                "details": [
                  {
                    "code": "owner_personal",
                    "params": {}
                  }
                ],
                "max_points": 30
              },
              {
                "key": "verified_domain",
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                "detail": "not applicable to user accounts",
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                    "code": "not_applicable_to_user_accounts",
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                "max_points": 20
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              {
                "key": "owner_reach",
                "name": "Owner reach",
                "detail": "70 followers of dralgroup",
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                "details": [
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                    "code": "owner_followers",
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                      "count": 70,
                      "login": "dralgroup"
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                  }
                ],
                "max_points": 25
              },
              {
                "key": "track_record",
                "name": "Track record",
                "detail": "24 public repos, account ~4 yr old",
                "points": 19,
                "status": "partial",
                "details": [
                  {
                    "code": "public_repos",
                    "params": {
                      "count": 24
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                  },
                  {
                    "code": "account_age_years",
                    "params": {
                      "years": 4
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                  }
                ],
                "max_points": 25
              }
            ]
          }
        ],
        "description": "Will the project survive its people — bus factor, responsiveness, who backs it, and package upkeep?"
      },
      {
        "key": "engineering",
        "band": "at_risk",
        "name": "Engineering Quality",
        "value": 44,
        "weight": 0.2,
        "metrics": [
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            "key": "engineering_practices",
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                "key": "ci_workflows",
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                "detail": "1 workflow(s)",
                "points": 24,
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                    "code": "ci_workflows",
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                "max_points": 24
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                "key": "tests_present",
                "name": "Tests present",
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              {
                "key": "linter_config",
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              {
                "key": "pre_commit_hooks",
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                "points": 0,
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              },
              {
                "key": "editorconfig",
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                "details": [],
                "max_points": 6.4
              },
              {
                "key": "openssf_scorecard_ci_tests",
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            ]
          },
          {
            "key": "documentation",
            "band": "good",
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            "note": null,
            "notes": [],
            "value": 75,
            "inputs": {
              "topics": [
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                "computational-chemistry",
                "machine-learning",
                "machine-learning-potential",
                "quantum-chemistry",
                "quantum-chemistry-programs",
                "quantum-mechanics",
                "deep-learning",
                "kernel-method",
                "kernel-ridge-regression",
                "neural-network"
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                "key": "documentation_homepage_site",
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                "key": "topics",
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                "key": "wiki",
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            ]
          }
        ],
        "description": "Are baseline engineering and documentation practices in place?"
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      {
        "key": "security",
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        "name": "Security",
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        "weight": 0.16,
        "metrics": [
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            "key": "security_posture",
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              },
              {
                "code": "weights_renormalized",
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            ],
            "value": 45,
            "inputs": {
              "source": "openssf_scorecard",
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                "key": "binary_artifacts",
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              },
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                "key": "branch_protection",
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                "points": 0,
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                "key": "cii_best_practices",
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                "detail": "no effort to earn an OpenSSF best practices badge detected",
                "points": 0,
                "status": "missed",
                "details": [],
                "max_points": 2.5
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              {
                "key": "code_review",
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              {
                "key": "contributors",
                "name": "Contributors",
                "detail": "project has 1 contributing companies or organizations -- score normalized to 3",
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                "details": [],
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              },
              {
                "key": "dangerous_workflow",
                "name": "Dangerous-Workflow",
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                "points": 10,
                "status": "met",
                "details": [],
                "max_points": 10
              },
              {
                "key": "dependency_update_tool",
                "name": "Dependency-Update-Tool",
                "detail": "no update tool detected",
                "points": 0,
                "status": "missed",
                "details": [],
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              },
              {
                "key": "fuzzing",
                "name": "Fuzzing",
                "detail": "project is not fuzzed",
                "points": 0,
                "status": "missed",
                "details": [],
                "max_points": 5
              },
              {
                "key": "license",
                "name": "License",
                "detail": "license file detected",
                "points": 2.5,
                "status": "met",
                "details": [],
                "max_points": 2.5
              },
              {
                "key": "maintained",
                "name": "Maintained",
                "detail": "14 commit(s) and 0 issue activity found in the last 90 days -- score normalized to 10",
                "points": 7.5,
                "status": "met",
                "details": [],
                "max_points": 7.5
              },
              {
                "key": "packaging",
                "name": "Packaging",
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                "points": 0,
                "status": "excluded",
                "details": [
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                    "code": "no_data",
                    "params": {}
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                ],
                "max_points": 5
              },
              {
                "key": "pinned_dependencies",
                "name": "Pinned-Dependencies",
                "detail": "dependency not pinned by hash detected -- score normalized to 0",
                "points": 0,
                "status": "missed",
                "details": [],
                "max_points": 5
              },
              {
                "key": "sast",
                "name": "SAST",
                "detail": "SAST tool is not run on all commits -- score normalized to 0",
                "points": 0,
                "status": "missed",
                "details": [],
                "max_points": 5
              },
              {
                "key": "security_policy",
                "name": "Security-Policy",
                "detail": "security policy file detected",
                "points": 5,
                "status": "met",
                "details": [],
                "max_points": 5
              },
              {
                "key": "signed_releases",
                "name": "Signed-Releases",
                "detail": "no releases found",
                "points": 0,
                "status": "excluded",
                "details": [
                  {
                    "code": "no_data",
                    "params": {}
                  }
                ],
                "max_points": 7.5
              },
              {
                "key": "token_permissions",
                "name": "Token-Permissions",
                "detail": "detected GitHub workflow tokens with excessive permissions",
                "points": 0,
                "status": "missed",
                "details": [],
                "max_points": 7.5
              },
              {
                "key": "vulnerabilities",
                "name": "Vulnerabilities",
                "detail": "0 existing vulnerabilities detected",
                "points": 7.5,
                "status": "met",
                "details": [],
                "max_points": 7.5
              }
            ]
          },
          {
            "key": "dependency_advisories",
            "band": "moderate",
            "name": "Dependency advisories",
            "note": "Matched the pypi:mlatom@3.23.4 runtime dependency closure — what installing the published package pulls in — 55 packages. Reachability is not analyzed.",
            "notes": [
              {
                "code": "advisories_scope_published",
                "params": {
                  "package": "pypi:mlatom@3.23.4",
                  "assessed": 55
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              },
              {
                "code": "advisories_reachability",
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              }
            ],
            "value": 64,
            "inputs": {
              "source": "osv",
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              "affected_packages": 2,
              "assessed_packages": 55,
              "unassessed_packages": 0,
              "affected_by_severity": "critical 1, moderate 1",
              "direct_affected_packages": 2
            },
            "components": [
              {
                "key": "direct_dependencies_free_of_known_advisories",
                "name": "Direct dependencies free of known advisories",
                "detail": "2 affected: torch 2.1.2 (critical 9.8), setuptools 80.10.2 (moderate 6.1)",
                "points": 6.6,
                "status": "partial",
                "details": [
                  {
                    "code": "advisories_affected",
                    "params": {
                      "count": 2,
                      "packages": "torch 2.1.2 (critical 9.8), setuptools 80.10.2 (moderate 6.1)"
                    }
                  }
                ],
                "max_points": 35
              },
              {
                "key": "indirect_dependencies_free_of_known_advisories",
                "name": "Indirect dependencies free of known advisories",
                "detail": "no indirect dependency carries a known advisory",
                "points": 25,
                "status": "met",
                "details": [
                  {
                    "code": "no_indirect_advisories",
                    "params": {}
                  }
                ],
                "max_points": 25
              },
              {
                "key": "no_advisories_left_outstanding",
                "name": "No advisories left outstanding",
                "detail": "1 advisory-carrying package(s) unaddressed past 90 days; oldest published 829 days ago",
                "points": 32.1,
                "status": "partial",
                "details": [
                  {
                    "code": "advisories_stale",
                    "params": {
                      "days": 90,
                      "count": 1,
                      "oldest": 829
                    }
                  }
                ],
                "max_points": 40
              }
            ]
          },
          {
            "key": "malicious_dependencies",
            "band": "excellent",
            "name": "Malicious dependencies",
            "note": null,
            "notes": [],
            "value": 100,
            "inputs": {
              "source": "osv",
              "meaning": "reported as a malicious package by the OpenSSF corpus; the remedy is removal or moving off the compromised name, never an upgrade of the same artifact. Versions the registry has since pulled are listed but not scored",
              "packages": [],
              "red_flag": false,
              "assessed_packages": 55,
              "malicious_packages": 0,
              "direct_malicious_packages": 0,
              "withdrawn_malicious_packages": 0,
              "installable_malicious_packages": 0
            },
            "components": [
              {
                "key": "no_dependency_reported_as_a_malicious_package",
                "name": "No dependency reported as a malicious package",
                "detail": "no dependency is reported as a malicious package",
                "points": 100,
                "status": "met",
                "details": [
                  {
                    "code": "no_malicious_dependencies",
                    "params": {}
                  }
                ],
                "max_points": 100
              }
            ]
          },
          {
            "key": "high_risk_jurisdiction_exposure",
            "band": "excellent",
            "name": "High-Risk Jurisdiction Exposure",
            "note": "Only high-confidence self-published location evidence affects this multiplier. Ambiguous matches are review-only; country evidence is not proof of nationality, citizenship, legal registration, malicious intent, or sanctions status.",
            "notes": [
              {
                "code": "jurisdiction_evidence_limits",
                "params": {}
              }
            ],
            "value": 100,
            "inputs": {
              "meaning": "self-published location evidence; not nationality or citizenship",
              "red_flag": false,
              "exposures": [],
              "policy_countries": [
                "Russia",
                "Iran",
                "North Korea"
              ],
              "review_only_matches": 0,
              "assessed_self_published_locations": 2
            },
            "components": [
              {
                "key": "policy_exposure_multiplier",
                "name": "Policy exposure multiplier",
                "detail": "no confirmed policy-scope location match",
                "points": 100,
                "status": "met",
                "details": [
                  {
                    "code": "jurisdiction_no_match",
                    "params": {}
                  }
                ],
                "max_points": 100
              }
            ]
          }
        ],
        "description": "Are visible security and supply-chain practices strong, with no malicious dependency and no unresolved high-risk jurisdiction exposure?"
      },
      {
        "key": "ai_readiness",
        "band": "at_risk",
        "name": "AI Readiness",
        "value": 40,
        "weight": 0,
        "metrics": [
          {
            "key": "ai_agent_context",
            "band": "moderate",
            "name": "Agent context & guidance",
            "note": null,
            "notes": [],
            "value": 65,
            "inputs": {
              "has_llms_txt": false,
              "legible_history_share": 0.38,
              "agent_instruction_files": [
                "AGENTS.md"
              ],
              "agent_instruction_max_bytes": 2804
            },
            "components": [
              {
                "key": "agent_instructions",
                "name": "Agent instructions",
                "detail": "AGENTS.md",
                "points": 45,
                "status": "met",
                "details": [
                  {
                    "code": "file_list",
                    "params": {
                      "files": "AGENTS.md"
                    }
                  }
                ],
                "max_points": 45
              },
              {
                "key": "machine_readable_docs_llms_txt",
                "name": "Machine-readable docs (llms.txt)",
                "detail": null,
                "points": 0,
                "status": "missed",
                "details": [],
                "max_points": 15
              },
              {
                "key": "legible_commit_history",
                "name": "Legible commit history",
                "detail": "38 of 100 human commits state their intent (structured subject or explanatory body)",
                "points": 20.3,
                "status": "partial",
                "details": [
                  {
                    "code": "legible_history",
                    "params": {
                      "legible": 38,
                      "sampled": 100
                    }
                  }
                ],
                "max_points": 40
              }
            ]
          },
          {
            "key": "ai_verify_loop",
            "band": "critical",
            "name": "Verify loop (build / test / typecheck)",
            "note": null,
            "notes": [],
            "value": 18,
            "inputs": {
              "has_nix": false,
              "has_tests": false,
              "lockfiles": [],
              "has_dockerfile": false,
              "typed_language": false,
              "bootstrap_files": [
                "mlatom/MLatomF_src/Makefile"
              ],
              "has_devcontainer": false,
              "has_linter_config": false,
              "typecheck_configs": [],
              "agent_commit_share": 0,
              "toolchain_manifests": [],
              "dependency_bot_commit_share": 0
            },
            "components": [
              {
                "key": "one_command_bootstrap",
                "name": "One-command bootstrap",
                "detail": "mlatom/MLatomF_src/Makefile",
                "points": 18,
                "status": "met",
                "details": [
                  {
                    "code": "file_list",
                    "params": {
                      "files": "mlatom/MLatomF_src/Makefile"
                    }
                  }
                ],
                "max_points": 18
              },
              {
                "key": "automated_tests",
                "name": "Automated tests",
                "detail": null,
                "points": 0,
                "status": "missed",
                "details": [],
                "max_points": 22
              },
              {
                "key": "lint_format_config",
                "name": "Lint / format config",
                "detail": null,
                "points": 0,
                "status": "missed",
                "details": [],
                "max_points": 11
              },
              {
                "key": "static_type_checking",
                "name": "Static type checking",
                "detail": null,
                "points": 0,
                "status": "missed",
                "details": [],
                "max_points": 11
              },
              {
                "key": "reproducible_environment",
                "name": "Reproducible environment",
                "detail": null,
                "points": 0,
                "status": "missed",
                "details": [],
                "max_points": 10
              },
              {
                "key": "demonstrated_agent_practice",
                "name": "Demonstrated agent practice",
                "detail": "no agent-authored commits among the last 100",
                "points": 0,
                "status": "missed",
                "details": [
                  {
                    "code": "no_agent_authored_commits",
                    "params": {
                      "sampled": 100
                    }
                  }
                ],
                "max_points": 10
              },
              {
                "key": "automated_maintenance",
                "name": "Automated maintenance",
                "detail": "no automated dependency updates observed",
                "points": 0,
                "status": "missed",
                "details": [
                  {
                    "code": "no_dependency_automation",
                    "params": {}
                  }
                ],
                "max_points": 8
              },
              {
                "key": "openssf_scorecard_pinned_dependencies",
                "name": "OpenSSF Scorecard: Pinned-Dependencies",
                "detail": "dependency not pinned by hash detected -- score normalized to 0",
                "points": 0,
                "status": "missed",
                "details": [],
                "max_points": 10
              }
            ]
          },
          {
            "key": "ai_code_legibility",
            "band": "moderate",
            "name": "Code legibility for models",
            "note": null,
            "notes": [],
            "value": 50,
            "inputs": {
              "primary_language": "Python",
              "largest_source_bytes": 195102,
              "source_files_sampled": 103,
              "oversized_source_files": 9
            },
            "components": [
              {
                "key": "type_checkable_code",
                "name": "Type-checkable code",
                "detail": "Python without a type-check config",
                "points": 0,
                "status": "missed",
                "details": [
                  {
                    "code": "no_typecheck_config_language",
                    "params": {
                      "language": "Python"
                    }
                  }
                ],
                "max_points": 45
              },
              {
                "key": "manageable_file_sizes",
                "name": "Manageable file sizes",
                "detail": "9/103 source files over 60KB",
                "points": 50.2,
                "status": "partial",
                "details": [
                  {
                    "code": "oversized_source_files",
                    "params": {
                      "kb": 60,
                      "sampled": 103,
                      "oversized": 9
                    }
                  }
                ],
                "max_points": 55
              }
            ]
          }
        ],
        "description": "How well is the repo equipped to be developed and maintained with AI coding agents? An independent, experimental badge — weight 0.0, so it is surfaced on its own and does not affect the overall health score."
      }
    ],
    "metrics_version": "1.13.0"
  },
  "warnings": [
    "Star history unavailable: GitHub GraphQL error: Resource not accessible by personal access token",
    "pypi package 'mlatom' points at a different repository (http://mlatom.com); excluded from ecosystem scoring"
  ],
  "report_type": "repository",
  "generated_at": "2026-07-26T07:04:13.993018Z",
  "schema_version": "0.27.0",
  "badge_url": "https://raw.githubusercontent.com/inspect-software/badges/main/v1/d/dralgroup/mlatom.svg",
  "full_name": "dralgroup/mlatom",
  "license_state": "standard",
  "license_spdx": "Apache-2.0"
}

评分是信号,而非担保。 评分反映的是 GitHub 上公开可见的实践——不是代码审计,也不是安全保证。

缺失数据将被剔除并重新归一化权重,绝不按零分计。方法论已版本化并公开:指标 v1.13.0、模式 v0.27.0—— 完整方法论 · 指标知识库.

单项结果在整体记录中的位置: 汇总统计PyPI.