Keywords = density functional theory
Number of Articles: 4
1. Study on Sunitinib Adsorption on Graphene Surface as an Anticancer Drug

Volume 12, Issue 1, Winter 2018, Pages 79-91

Sepideh Tanreh; Abolghasem Shameli; Ebrahim Balali


2. A Theoretical Study on Applying Conformational Analysis of 2-Halo-2-Oxo-1,3,2-Dioxaphosphorinanes

Volume 10, Issue 1, Winter 2016, Pages 83-94

Fatemeh Azarakhshi; Nazanin Farhadyar; Mehrnoosh Khaleghian


3. Applying Density Functional Theory to Study NLO Properties of Benzyne-Based Chromophores

Volume 9, Issue 4, Autumn 2015, Pages 7-17

Reza Ghiasi; Azadeh Heidarbeigi


4. Relationship between 13C NMR Parameters and Antimalarial activity of Cryptolepine Isosteres

Volume 9, Issue 3, Summer 2015, Pages 19-26

Mohamad Reza Talei Bavil Olyai; Hadi Behzadi; Payman Roonasi