CAT: A Compound Attachment Tool for the Construction of Composite Chemical Compounds
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DOI: 10.1021/acs.jcim.2c00690
Abstract: The continuous improvement of computer architectures allows for the simulation of molecular systems of growing sizes. However, such calculations still require the input of initial structures, which are also becoming increasingly complex. In this work,… read more here.
Keywords: construction composite; attachment tool; chemical compounds; composite chemical ... See more keywords