🤖 AI Analysis

Final verdict: SAFE

The package exhibits minimal risks with no network calls, obfuscation, or credential harvesting. Shell commands are limited to version control, suggesting benign intent.

No network calls detected
Shell commands used for version control only
No signs of obfuscation or credential harvesting

Per-check LLM notes

Network: No network calls detected, which is normal and expected.
Shell: The shell command usage appears to be for version control purposes, likely safe but should be monitored.
Obfuscation: No obfuscation patterns detected, indicating low risk.
Credentials: No credential harvesting patterns detected, indicating low risk.

🔬 Heuristic Checks

✓ Outbound Network Calls

No suspicious network call patterns found

✓ Code Obfuscation

No obfuscation patterns detected

⚠ Shell / Subprocess Execution score 2.0

Found 1 shell execution pattern(s)

ackaging.version.Version( subprocess.check_output( ["git", "describe", "--abbrev=0", "--tags"], ).

✓ Credential Harvesting

No credential harvesting patterns detected

✓ Typosquatting

No typosquatting candidates detected

✓ Registered Email Domain

Email domain looks legitimate: openforcefield.org>

✓ Suspicious Page Links

All external links appear legitimate

✓ Git Repository History

No GitHub repository linked

No GitHub repository link found

⚠ Maintainer History score 4.0

2 maintainer concern(s) found

Author name is missing or very short
Author "" appears to have only 1 package on PyPI (new or inactive account)

✓ Known CVE Vulnerabilities

No known vulnerabilities found in OSV database.

💡 AI App Starter Prompt

Use this prompt to build a project with acellera-openff-interchange

Create a mini-application called 'MolMechConverter' that leverages the 'acellera-openff-interchange' package to store, manipulate, and convert molecular mechanics data into various formats such as SMIRNOFF, FFXML, and JSON. The application should provide a user-friendly interface where users can upload their molecular mechanics data file (e.g., .smirnoff or .ffxml), select the desired output format from a dropdown menu, and initiate the conversion process with a button click. Additionally, the application should support the following features:

1. **File Upload Handling:** Implement a feature that allows users to upload files containing molecular mechanics parameters in supported formats.
2. **Conversion Process:** Once the file is uploaded and the output format is selected, the application should use the 'acellera-openff-interchange' package to read the input file, perform any necessary manipulations, and then write out the converted file in the chosen format.
3. **Error Handling & Feedback:** Provide meaningful error messages and feedback to the user if there are issues with the input file format, missing required fields, or other errors during the conversion process.
4. **Preview Functionality:** Offer a preview of the converted content before finalizing the conversion process. This could include displaying a summary of the key parameters or a snippet of the converted file contents.
5. **Documentation & Help:** Include a brief guide on how to use the application and a list of supported input/output formats along with examples.
6. **Optional Advanced Features:** Consider adding advanced options such as parameter optimization, compatibility checks between different force field definitions, or integration with external databases for additional parameter sets.

The application should be designed with modularity in mind, allowing for easy expansion of supported formats and additional functionalities in the future. Ensure that all interactions with the 'acellera-openff-interchange' package are well-documented and clearly explained within the codebase.