UQ-ATB file repository
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资源简介：
The ATB database includes optimized geometries and atomic interaction parameters for over 180,000 molecules along and has over 6500 registered users worldwide. The data is accessed by hundreds or researchers daily. The requested resources will be used primarily to generate, store and serve molecular fragments which are used to enable the rapid identification and parametrization of novel molecules submitted to the main ATB web site.
创建时间：
2022-03-17
