✦ LIBER ✦

Design and Characterization of Small Molecule Inhibitors of the PICK1 PDZ Domain with Binding Free Energy Calculations

✍ Scribed by Moreira, Irina; Ge, Xiaoxia; Madsen, Kenneth L.; Gether, Ulrik; Weinstein, Harel

Book ID: 122298329
Publisher: Biophysical Society
Year: 2010
Tongue: English
Weight: 34 KB
Volume: 98
Category: Article
ISSN: 0006-3495
DOI: 10.1016/j.bpj.2009.12.2319

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

436 POSTER The design, synthesis and ant

436 POSTER The design, synthesis and antitumour evaluation of novel small molecule inhibitors of the Dishevelled PDZ domain

✍ H. Kadri; T.C. Dale; K.B.R. Ewan; A.D. Westwell 📂 Article 📅 2008 🏛 Elsevier Science 🌐 English ⚖ 135 KB

Structure of PICK1 and other PDZ domains

Structure of PICK1 and other PDZ domains obtained with the help of self-binding C-terminal extensions

✍ Jonathan M. Elkins; Evangelos Papagrigoriou; Georgina Berridge; Xiaowen Yang; Cl 📂 Article 📅 2007 🏛 Cold Spring Harbor Laboratory Press 🌐 English ⚖ 672 KB

An in silico virtual screening study for

An in silico virtual screening study for the design of norovirus inhibitors: fragment-based molecular docking and binding free energy calculations

✍ Lundborg, Magnus; Ali, Eunus; Widmalm, Göran 📂 Article 📅 2013 🏛 Elsevier Science 🌐 English ⚖ 718 KB

The application of three approximate fre

The application of three approximate free energy calculations methods to structure based ligand design: Trypsin and its complex with inhibitors

✍ Randall J. Radmer; Peter A. Kollman 📂 Article 📅 1998 🏛 Springer Netherlands 🌐 English ⚖ 389 KB

Prediction of the Binding Free Energies

Prediction of the Binding Free Energies of New TIBO-like HIV-1 Reverse Transcriptase Inhibitors Using a Combination of PROFEC, PB/SA, CMC/MD, and Free Energy Calculations

✍ Eriksson, Mats A. L.; Pitera, Jed; Kollman, Peter A. 📂 Article 📅 1999 🏛 American Chemical Society 🌐 English ⚖ 300 KB

ChemInform Abstract: Recent Advances wit

ChemInform Abstract: Recent Advances with the CRF1 Receptor: Design of Small Molecule Inhibitors, Receptor Subtypes and Clinical Indications

✍ James R. McCarthy; Stephen C. Heinrichs; Dimitri E. Grigoriadis 📂 Article 📅 2010 🏛 John Wiley and Sons ⚖ 27 KB 👁 1 views