OpenMolGRID, a GRID Based System for Solving Large-Scale Drug Design Problems

Author:

Darvas Ferenc,Papp Ákos,Bágyi István,Ambrus Géza,Ürge László

Publisher

Springer Berlin Heidelberg

Reference17 articles.

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2. Lipinski, C.A.: Drug-like properties and the causes of poor solubility and poor permeability. J. Pharmacol. Toxicol. Methods. 44(1), 235–249 (2000)

3. Kramer, S.D.: Absorption prediction from physicochemical parameters. Pharm. Sci. Technol. Today 2, 373–380 (1999)

4. Matter, H., Baringhaus, K.-H., Naumann, T., Klaubunde, T., Pirard, B.: Computational Approaches towards the Rational Design of Drug-like Compound Libraries. Comb. Chem & HTS 4, 453–475 (2001)

5. Ghose, A.K., Vishwanadhan, V.N., Wendoloshki, J.J.: A Knowledge-Based Approach in Designing Combinatorial or Medicinal Chemistry Libraries for Drug Discovery. 1. A Qualitative and Quantitative Characterization of Known Drug Databases. J. Comb. Chem. 1, 55–68 (1999)

Cited by 2 articles. 订阅此论文施引文献 订阅此论文施引文献,注册后可以免费订阅5篇论文的施引文献,订阅后可以查看论文全部施引文献

1. Advances in distributed computing with modern drug discovery;Expert Opinion on Drug Discovery;2018-12-13

2. Grid Services for Parallel Molecular Dynamics with NAMD and CHARMM;Computational Science and Its Applications – ICCSA 2008

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