Literature DB >> 14631817

Protein simulation and drug design.

Chung F Wong1, Andrew J McCammon.   

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Year:  2003        PMID: 14631817     DOI: 10.1016/s0065-3233(03)66003-1

Source DB:  PubMed          Journal:  Adv Protein Chem        ISSN: 0065-3233


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  9 in total

Review 1.  Virtual screening: an endless staircase?

Authors:  Gisbert Schneider
Journal:  Nat Rev Drug Discov       Date:  2010-04       Impact factor: 84.694

2.  Patterns of protein protein interactions in salt solutions and implications for protein crystallization.

Authors:  André C Dumetz; Ann M Snellinger-O'brien; Eric W Kaler; Abraham M Lenhoff
Journal:  Protein Sci       Date:  2007-09       Impact factor: 6.725

3.  Stabilization of anionic and neutral forms of a fluorophoric ligand at the active site of human carbonic anhydrase I.

Authors:  Sumathra Manokaran; Jayati Banerjee; Sanku Mallik; D K Srivastava
Journal:  Biochim Biophys Acta       Date:  2010-07-08

4.  Using machine learning to improve ensemble docking for drug discovery.

Authors:  Tanay Chandak; John P Mayginnes; Howard Mayes; Chung F Wong
Journal:  Proteins       Date:  2020-05-25

Review 5.  Mathematical models in biology: from molecules to life.

Authors:  Yiannis N Kaznessis
Journal:  Wiley Interdiscip Rev Syst Biol Med       Date:  2011-02-18

6.  Recent Developments and Applications of the CHARMM force fields.

Authors:  Xiao Zhu; Pedro E M Lopes; Alexander D Mackerell
Journal:  Wiley Interdiscip Rev Comput Mol Sci       Date:  2011-06-28

Review 7.  Molecular dynamics: survey of methods for simulating the activity of proteins.

Authors:  Stewart A Adcock; J Andrew McCammon
Journal:  Chem Rev       Date:  2006-05       Impact factor: 60.622

8.  A population-based evolutionary search approach to the multiple minima problem in de novo protein structure prediction.

Authors:  Sameh Saleh; Brian Olson; Amarda Shehu
Journal:  BMC Struct Biol       Date:  2013-11-08

9.  Development and Validation of a DFT-Based Force Field for a Hydrated Homoalanine Polypeptide.

Authors:  Ying Yuan; Zhonghua Ma; Feng Wang
Journal:  J Phys Chem B       Date:  2021-02-08       Impact factor: 2.991

  9 in total

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