Symbolic calculation in chemistry: Selected examples 论文
2004International Journal of Quantum Chemistry引用 242
Computational Drug Discovery MethodsMolecular spectroscopy and chiralityTopological and Geometric Data Analysis
摘要
Abstract A selective classified bibliography of symbolic computation in some areas of chemistry is provided together with some examples of computer algebra algorithms and techniques to facilitate future joint work of chemists and computer scientists. © 2004 Wiley Periodicals, Inc. Int J Quantum Chem, 2004