검색결과 : 2건
| No. | Article |
|---|---|
| 1 |
High-Throughput Calculations of Molecular Properties in the MedeA Environment: Accuracy of PM7 in Predicting Vibrational Frequencies, Ideal Gas Entropies, Heat Capacities, and Gibbs Free Energies of Organic Molecules Rozanska X, Stewart JJP, Ungerer P, Leblanc B, Freeman C, Saxe P, Wimmer E Journal of Chemical and Engineering Data, 59(10), 3136, 2014 |
| 2 |
A theoretical study of pyrimidine photohydrates and a proposed mechanism for the mutagenic effect of ultraviolet light Danilov VI, Stewart JJP, Les A, Alderfer JL Chemical Physics Letters, 328(1-2), 75, 2000 |