Best Practices on QM/MM Simulations of Biological Systems
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DOI: 10.1021/acs.jcim.2c01522
Abstract: During the second half of the 20th century, following structural biology hallmark works on DNA and proteins, biochemists shifted their questions from "what does this molecule look like?" to "how does this process work?". Prompted… read more here.
Keywords: biological systems; best practices; chemistry; practices simulations ... See more keywords