𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Progress in the Understanding of the Key Pharmacophoric Features of the Antimalarial Drug Dihydroartemisinin: An Experimental and Theoretical Charge Density Study

✍ Scribed by Saleh, Gabriele; Soave, Raffaella; Lo Presti, Leonardo; Destro, Riccardo


Book ID
121808971
Publisher
John Wiley and Sons
Year
2013
Tongue
English
Weight
1002 KB
Volume
19
Category
Article
ISSN
0947-6539

No coin nor oath required. For personal study only.


📜 SIMILAR VOLUMES


Understanding the NN bond cleavage and t
✍ Gnanasekaran Rajalakshmi; Balu Devipriya; Azhagesan Renuga Parameswari; Arputhar 📂 Article 📅 2011 🏛 Elsevier 🌐 English ⚖ 826 KB

Charge density distribution and the electrostatic properties of isoniazid drug molecule have been computed from HF and DFT methods with the basis set 6-311G ⁄⁄ using Bader's theory of atoms in molecules. The molecular geometric parameters predicted by DFT method are in agreement with the reported va

Progress in the Understanding of Drug–Re
✍ Riccardo Destro; Raffaella Soave; Mario Barzaghi; Leonardo Lo Presti 📂 Article 📅 2005 🏛 John Wiley and Sons 🌐 English ⚖ 548 KB

## Abstract An experimental study of the electron‐density distribution __ρ__(__**r**__) in an angiotensin II receptor antagonist **1** has been made on the basis of single‐crystal X‐ray diffraction data collected at a low temperature. The crystal structure of **1** consists of infinite ribbons in w

Progress in the Understanding of Drug–Re
✍ Raffaella Soave; Mario Barzaghi; Riccardo Destro 📂 Article 📅 2007 🏛 John Wiley and Sons 🌐 English ⚖ 558 KB

## Abstract A combined experimental and theoretical charge density study of an angiotensin II receptor antagonist (**1**) is presented focusing on electrostatic properties such as atomic charges, molecular electric moments up to the fourth rank and energies of the intermolecular interactions, to ga