Gaussian Process Regression for Transition State Search
نویسندگان
چکیده
منابع مشابه
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ژورنال
عنوان ژورنال: Journal of Chemical Theory and Computation
سال: 2018
ISSN: 1549-9618,1549-9626
DOI: 10.1021/acs.jctc.8b00708