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Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology |
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| semi-empirical | AM1 | 2743R |
|---|---|---|
| PM3 | 2640R | |
| PM6 | 2418 | |
| composite | G3MP2 | 2758 |
| molecular mechanics | DREIDING | 1881 |
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