Skill-Audit-Bericht
chem-dft-orca-optimization Audit-Bericht.
Run DFT geometry optimization (minimization or TS search) on a molecular structure using ORCA via SCINE/ReaDuct wrapper.
OpenAgentSkill Trust Score
OpenAgentSkill Trust Score
The Trust Score helps an agent decide whether a skill is safe enough to shortlist before installation.
GitHub-Akzeptanz
Info62
161 GitHub-Stars
Star-/Fork-Aktivität
Warnung57
161 Stars und 24 Forks; Issue-Aktivität ist in den aktuellen Metadaten nicht verfügbar
Aktuelle Wartung
Bestanden88
1 Monate seit dem letzten Push
Lizenzklarheit
Bestanden86
MIT
README/SKILL.md-Vollständigkeit
Bestanden86
Metadaten enthalten ausreichend Nutzungs- und Workflow-Kontext
Abhängigkeits-/Laufzeitrisiko
Warnung54
command execution surface, credential or environment access
Installationsverfügbarkeit
Bestanden92
npx skills add learningmatter-mit/AtomisticSkills --skill chem-dft-orca-optimization
Sicherheit des Installationsbefehls
Bestanden92
Standard-Paket- oder Laufzeit-Installationspfad
Berechtigungsumfang
Fehlgeschlagen36
secrets or environment access, shell or command execution
Repository-Nachweis
Bestanden86
https://github.com/learningmatter-mit/AtomisticSkills/tree/main/.agents/skills/chem-dft-orca-optimization
Prüfstatus
Info66
KI-Prüfdaten verfügbar
Agent-validierte Ergebnisse
Info54
Noch keine Agent-Ergebnisdaten
Prüfungen
Installations- und Adoptionsprüfung
Installationspfad
92
npx skills add learningmatter-mit/AtomisticSkills --skill chem-dft-orca-optimization
Repository
88
https://github.com/learningmatter-mit/AtomisticSkills/tree/main/.agents/skills/chem-dft-orca-optimization
Lizenz
86
MIT
Wartung
88
1 Monate seit dem letzten Push
KI-Prüfung
55
The SKILL.md excerpt is truncated, but the provided content is comprehensive and well-structured.
README/SKILL.md-Vollständigkeit
86
Usable description available
Abhängigkeitsrisiko
54
command execution surface, credential or environment access
Sicherheit des Installationsbefehls
92
Standard-Paket- oder Laufzeit-Installationspfad
Berechtigungsumfang
36
secrets or environment access, shell or command execution
Star-/Fork-Aktivität
57
161 Stars und 24 Forks; Issue-Aktivität ist in den aktuellen Metadaten nicht verfügbar
Akzeptanz
68
161 GitHub-Stars
Financial decision safety
58
Research-only use: do not treat output as financial advice or execute a position without human approval.
Warnungen
- Dependency or permission surface needs review
- Permission surface may require sandboxing
- Financial research output is not financial advice; require human review before any live investment decision
- The SKILL.md excerpt is truncated, but the provided content is comprehensive and well-structured.
- The skill depends on external software (ORCA, SCINE) and a specific conda environment, which may limit portability but is clearly documented.
- Financial research output is not financial advice; require human review before any live investment decision.
- Quality score needs review
- Permission surface needs review: secrets or environment access, shell or command execution
- Stars/forks activity: 161 stars, 24 forks; issue activity unavailable in current metadata
- Dependency/runtime risk: command execution surface, credential or environment access
- Permission surface: secrets or environment access, shell or command execution
Methode
This report combines public metadata, AI review output, repository freshness, install readiness, OpenAgentSkill events, quality scoring, trust checks, and the agent safety gate. It is not a full source-code security review.
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