검색결과 : 4건
No. | Article |
---|---|
1 |
Effects of the Level of Electronic Structure Theory on the Dynamics of the F- + CH3I Reaction Gyori T, Olasz B, Paragi G, Czako G Journal of Physical Chemistry A, 122(13), 3353, 2018 |
2 |
Self-Assembly of N-3-Substituted Xanthines in the Solid State and at the Solid-Liquid Interface Ciesielski A, Haar S, Benyei A, Paragi G, Guerra CF, Bickelhaupt FM, Masiero S, Szolomajer J, Samori P, Spada GP, Kovacs L Langmuir, 29(24), 7283, 2013 |
3 |
Combination of a modified scoring function with two-dimensional descriptors for calculation of binding affinities of bulky, flexible ligands to proteins Hetenyi C, Paragi G, Maran U, Timar Z, Karelson M, Penke B Journal of the American Chemical Society, 128(4), 1233, 2006 |
4 |
Investigation of exchange potentials for excited states by parameter fitting Paragi G, Gyemant IK, Van Doren VE Chemical Physics Letters, 324(5-6), 440, 2000 |