Use of Extended-Hückel Descriptors for Rapid and Accurate Predictions of Conjugated Torsional Energy Barriers

Article

Abstract: Over the past few decades, virtual high-throughput screening (vHTS) and molecular dynamics simulatio

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Autores:

Champion C., Labute P., Liu Z., Moitessier N., Stephen Jones Barigye, Wei W.

Fuentes:

scopus