Signature | ||||
|---|---|---|---|---|
| GET | Health Check | none→JSON | Public | |
| POST | Calculate IR Spectrum | file→JSON | Public | |
| GET | List Supported Formats | none→JSON | Public | |
| POST | Calculate Thermochemistry | file→JSON | Public | |
| POST | Analyze Structure | file→JSON | Public |
API for molecular calculations using g-XTB
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