By Hans-Joachim Böhm, Gisbert Schneider, Raimund Mannhold, Hugo Kubinyi, Gerd Folkers

ISBN-10: 3527305211

ISBN-13: 9783527305216

The lock-and-key precept formulated by way of Emil Fischer as early because the finish of the nineteenth century has nonetheless now not misplaced any of its importance for the lifestyles sciences. the fundamental features of ligand-protein interplay could be summarized below the time period 'molecular attractiveness' and challenge the specificity in addition to balance of ligand binding. Molecular reputation is therefore a important subject within the improvement of lively ingredients, for the reason that balance and specificity confirm no matter if a substance can be utilized as a drug. these days, computer-aided prediction and clever molecular layout make a wide contribution to the consistent look for, e. g., more suitable enzyme inhibitors, and new options corresponding to that of pharmacophores are being constructed. An up to date presentation of an perpetually younger subject, this e-book is an crucial info resource for chemists, biochemists and pharmacologists facing the binding of ligands to proteins.

Show description

Read Online or Download Protein-Ligand Interactions: From Molecular Recognition to Drug Design PDF

Similar pharmacy books

Pharmacokinetics and Metabolism in Drug Design by Dennis A. Smith, Charlotte Allerton, Amit S. Kalgutkar, Han PDF

The scientific merits of a drug aren't simply depending on its organic impression, but in addition on its "life cycle" in the organism - from its absorption into the blood, distribution to tissue until eventually its eventual breakdown or excretion by means of the liver and kidneys. right here, the authors, them all hired at Pfizer within the discovery and improvement of recent energetic elements, speak about the numerous parameters and approaches vital for the absorption, distribution and retention of drug compounds within the physique, plus the capability difficulties created via their transformation into poisonous byproducts.

Read e-book online Stability of Drugs and Dosage Forms PDF

Drug items are complicated combinations of gear and excipients and, as such, their chemical and actual balance kinetics are advanced. This ebook discusses the steadiness of those dosage types with preformulation experiences via to the stories at the ultimate items. The e-book is meant for graduate scholars, researchers and pros within the box of Pharmaceutics and Pharmaceutical Chemistry.

Batch processing : modeling and design by Urmila Diwekar PDF

Even supposing batch processing has existed for a very long time, designing those strategies and unit operations has been thought of an exhausting job that required computational efforts. layout of those techniques is made extra complicated as a result time based nature of the method and the allowable flexibility.

Download PDF by Mark A. Simmons: Pharmacology - An Illustrated Review

The ideal examine instrument for getting ready on your classes or examinations - Pharmacology - An Illustrated reports concentrated presentation and full-color illustrations makes studying the complicated details necessary to good fortune more straightforward. Sidebars make connections to underlying recommendations in different easy sciences or observe the techniques awarded within the medical environment.

Additional resources for Protein-Ligand Interactions: From Molecular Recognition to Drug Design

Sample text

Weber, J. -Aided Mol. Design, 1999, 13, 51. -J. Boehm, M. Boehringer, D. Bur, H. Gmuender, W. Huber, W. Klaus, D. Kostrewa, H. Kuehne, T. Luebbers, N. Meunier-Keller and F. Mueller, J. Med. , 2000, 43, 2664. G. Gohlke, in Virtual Screen- 19 20 1 Prediction of Non-bonded Interactions in Drug Design ing for Bioactive Molecules, G. -J. ), VCH, Weinheim, 2000, p. 207. 92 R. E. Babine, T. M. Bleckman, C. R. Kissinger, R. Showalter, L. A. Pelletier, C. Lewis, K. Tucker, E. Moomaw, H. E. Parge, J. E. Villafranca, Bioorg.

D. J. Grootenhuis and P. J. M. , 1995, D51, 560. D. A. Pearlman and P. A. Charifson, J. Med. Chem. 2001, 44, 502. D. A. Pearlman, J. Med. , 1999, 42, 4313. I. D. Kuntz, K. Chen, K. A. Sharp and P. A. Kollman, Proc. Natl. Acad. Sci. USA, 1999, 96, 9997. Ajay and M. A. Murcko, J. Med. Chem. 1995, 38, 4953. J. D. Hirst, Curr. Op. Drug Disc. Dev. 1998, 1, 28. J. R. H. Tame, J. -Aided Mol. Design, 1999, 13, 99. -J. Boehm and M. Stahl, Med. Chem. Res. 1999, 9, 445. -J. Boehm, J. -Aided Mol. Design, 1998, 12, 309–323.

Ben-Naim, Hydrophobic Interactions, Plenum, New York, 1980. C. Tanford, The Hydrophobic Effect, Wiley, New York, 1980. F. M. Richards, Annu. Rev. Biophys. , 1977, 6, 151. K. A. Sharp, A. Nicholls, R. Friedman and B. Honig, Biochemistry, 1991, 30, 9686. G. Lange, D. Lesuisse, P. Deprez, B. Schoot, P. Loenze, D. P. Marquette, P. Broto, E. Sarubbi, E. Mandine, J. Med. Chem. 2002, 45, 2915– 2922. -J. Boehm, J. -Aided Mol. Design, 1994, 8, 243. M. K. Gilson, J. A. Given, B. L. Bush and J. A. McCammon, Biophys.

Download PDF sample

Protein-Ligand Interactions: From Molecular Recognition to Drug Design by Hans-Joachim Böhm, Gisbert Schneider, Raimund Mannhold, Hugo Kubinyi, Gerd Folkers


by John
4.4

Rated 4.84 of 5 – based on 34 votes