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Volumn 3594, Issue , 2005, Pages 214-217

The BioPAUÁ project: A portal for molecular dynamics using Grid environment

Author keywords

[No Author keywords available]

Indexed keywords

BIOCHEMISTRY; BIOMEDICAL ENGINEERING; COMPUTER SIMULATION; SILICA; BIOTECHNOLOGY;

EID: 26444442041     PISSN: 03029743     EISSN: None     Source Type: Conference Proceeding    
DOI: 10.1007/11532323_26     Document Type: Conference Paper
Times cited : (4)

References (8)
  • 1
    • 0033879436 scopus 로고    scopus 로고
    • Biomolecular reaction simulation using weighted ensemble brownian dynamics and the university of Houston brownian dynamics program
    • Rojnuckarin, A., Livesay, D. R., Subramaniam, S.: Biomolecular Reaction Simulation Using Weighted Ensemble Brownian Dynamics and the University of Houston Brownian Dynamics Program. Biophysical Journal 79 (2000) 686-693
    • (2000) Biophysical Journal , vol.79 , pp. 686-693
    • Rojnuckarin, A.1    Livesay, D.R.2    Subramaniam, S.3
  • 3
    • 26444608175 scopus 로고    scopus 로고
    • Molecular dynamics simulations applied to the study of subtypes of HIV 1 protease common to Brazil, Africa and Asia
    • in press
    • Batista, P., Wilter, A. Durham, E. H. A. B., Pascutti, P. G.: Molecular Dynamics Simulations Applied to the Study of Subtypes of HIV 1 Protease Common to Brazil, Africa and Asia. Journal Cell Biochemistry and Biophysics (2005) in press
    • (2005) Journal Cell Biochemistry and Biophysics
    • Batista, P.1    Wilter, A.2    Durham, E.H.A.B.3    Pascutti, P.G.4
  • 4
    • 26444617830 scopus 로고    scopus 로고
    • Molecular modeling and dynamics of falcipain-2 protease complexes, a contribution for drug development against malaria
    • Submitted to
    • Gomes, D. E. B., Rössle, S. C. S., Bisch, P. M., Pascutti, P. G.: Molecular Modeling and Dynamics of Falcipain-2 Protease Complexes, a Contribution for Drug Development against Malaria. Submitted to Biophysical Chemistry (2005)
    • (2005) Biophysical Chemistry
    • Gomes, D.E.B.1    Rössle, S.C.S.2    Bisch, P.M.3    Pascutti, P.G.4
  • 5
    • 26444557104 scopus 로고    scopus 로고
    • Molecular dynamics of the interaction of plasmodium falciparum and human serine hydroxymethyltransferase with 5-formyl-6-hydrofolic acid analogues: Design of new potential antimalarials
    • Submitted to
    • França, T. C. C., Wilter, A., Ramalho, T. C., Pascutti, P. G., Figueroa-Villar, J. D.: Molecular Dynamics of the Interaction of Plasmodium falciparum and Human Serine Hydroxymethyltransferase with 5-Formyl-6-hydrofolic Acid Analogues: Design of New Potential Antimalarials. Submitted to Journal of Computer-Aided Molecular Design (2005)
    • (2005) Journal of Computer-aided Molecular Design
    • França, T.C.C.1    Wilter, A.2    Ramalho, T.C.3    Pascutti, P.G.4    Figueroa-Villar, J.D.5
  • 7
    • 0030158429 scopus 로고    scopus 로고
    • PRODRG, a program for generating molecular topologies and unique molecular descriptors from coordinates of small molecules
    • van Aalten, D.M., Bywater, R., Findlay, J.B., Hendlich, M., Hooft, R.W., Vriend, G.: PRODRG, a Program for Generating Molecular Topologies and Unique Molecular Descriptors from Coordinates of Small Molecules. J. Comput. Aided Mol. Des. 10 (1996) 255-262
    • (1996) J. Comput. Aided Mol. Des. , vol.10 , pp. 255-262
    • Van Aalten, D.M.1    Bywater, R.2    Findlay, J.B.3    Hendlich, M.4    Hooft, R.W.5    Vriend, G.6


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