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Volumn 2014, Issue , 2014, Pages

In silico investigation of traditional chinese medicine compounds to inhibit human histone deacetylase 2 for patients with Alzheimer's disease

Author keywords

[No Author keywords available]

Indexed keywords

BONTL FERULATE; CHINESE DRUG; HISTONE DEACETYLASE 2; HISTONE DEACETYLASE INHIBITOR; MONOMETHYLCURCUMIN; NATURAL PRODUCT; NINGPOSIDE C; SPINACETIN; UNCLASSIFIED DRUG; YAKUCHINONE B; ENZYME INHIBITOR; HDAC2 PROTEIN, HUMAN; LIGAND;

EID: 84904103306     PISSN: 23146133     EISSN: 23146141     Source Type: Journal    
DOI: 10.1155/2014/769867     Document Type: Article
Times cited : (15)

References (59)
  • 7
    • 76749091005 scopus 로고    scopus 로고
    • Inhibitors of class 1 histone deacetylases reverse contextual memory deficits in a mouse model of Alzheimer's disease
    • 2-s2.0-76749091005 10.1038/npp.2009.197
    • Kilgore M., Miller C. A., Fass D. M., Hennig K. M., Haggarty S. J., Sweatt J. D., Rumbaugh G., Inhibitors of class 1 histone deacetylases reverse contextual memory deficits in a mouse model of Alzheimer's disease. Neuropsychopharmacology 2010 35 4 870 880 2-s2.0-76749091005 10.1038/npp.2009.197
    • (2010) Neuropsychopharmacology , vol.35 , Issue.4 , pp. 870-880
    • Kilgore, M.1    Miller, C.A.2    Fass, D.M.3    Hennig, K.M.4    Haggarty, S.J.5    Sweatt, J.D.6    Rumbaugh, G.7
  • 10
    • 67649514821 scopus 로고    scopus 로고
    • Learning and memory: HDAC2 is the one
    • 2-s2.0-67649514821 10.1038/nrn2660
    • Welberg L., Learning and memory: HDAC2 is the one. Nature Reviews Neuroscience 2009 10 7 471 2-s2.0-67649514821 10.1038/nrn2660
    • (2009) Nature Reviews Neuroscience , vol.10 , Issue.7 , pp. 471
    • Welberg, L.1
  • 12
    • 84868549261 scopus 로고    scopus 로고
    • Mercaptoacetamide-based class II HDAC inhibitor lowers A β levels and improves learning and memory in a mouse model of Alzheimer's disease
    • 2-s2.0-84868549261 10.1016/j.expneurol.2012.10.005
    • Sung Y. M., Lee T., Yoon H., DiBattista A. M., Song J. M., Sohn Y., Moffat E. I., Turner R. S., Jung M., Kim J., Hoe H.-S., Mercaptoacetamide-based class II HDAC inhibitor lowers A β levels and improves learning and memory in a mouse model of Alzheimer's disease. Experimental Neurology 2013 239 1 192 201 2-s2.0-84868549261 10.1016/j.expneurol.2012.10.005
    • (2013) Experimental Neurology , vol.239 , Issue.1 , pp. 192-201
    • Sung, Y.M.1    Lee, T.2    Yoon, H.3    Dibattista, A.M.4    Song, J.M.5    Sohn, Y.6    Moffat, E.I.7    Turner, R.S.8    Jung, M.9    Kim, J.10    Hoe, H.-S.11
  • 13
    • 33845615494 scopus 로고    scopus 로고
    • Cancer biology: Mechanism of antitumour action of vorinostat (suberoylanilide hydroxamic acid), a novel histone deacetylase inhibitor
    • DOI 10.1038/sj.bjc.6603463, PII 6603463
    • Richon V. M., Cancer biology: mechanism of antitumour action of vorinostat (suberoylanilide hydroxamic acid), a novel histone deacetylase inhibitor. The British Journal of Cancer 2006 95 1 S2 S6 2-s2.0-33845615494 10.1038/sj.bjc.6603463 (Pubitemid 44950782)
    • (2006) British Journal of Cancer , vol.95 , Issue.SUPPL. 1
    • Richon, V.M.1
  • 14
    • 84860334379 scopus 로고    scopus 로고
    • A novel series of l-2-benzyloxycarbonylamino-8-(2-pyridyl)- disulfidyloctanoic acid derivatives as histone deacetylase inhibitors: Design, synthesis and molecular modeling study
    • 2-s2.0-84860334379 10.1016/j.ejmech.2012.03.009
    • Huang D., Li X., Wei Y., Xiu Z., A novel series of l-2- benzyloxycarbonylamino-8-(2-pyridyl)-disulfidyloctanoic acid derivatives as histone deacetylase inhibitors: design, synthesis and molecular modeling study. European Journal of Medicinal Chemistry 2012 52 111 122 2-s2.0-84860334379 10.1016/j.ejmech.2012.03.009
    • (2012) European Journal of Medicinal Chemistry , vol.52 , pp. 111-122
    • Huang, D.1    Li, X.2    Wei, Y.3    Xiu, Z.4
  • 16
    • 34250026412 scopus 로고    scopus 로고
    • Histone deacetylase inhibitors enhance memory and synaptic plasticity via CREB: CBP-dependent transcriptional activation
    • DOI 10.1523/JNEUROSCI.0296-07.2007
    • Vecsey C. G., Hawk J. D., Lattal K. M., Stein J. M., Fabian S. A., Attner M. A., Cabrera S. M., McDonough C. B., Brindle P. K., Abel T., Wood M. A., Histone deacetylase inhibitors enhance memory and synaptic plasticity via CREB: CBP-dependent transcriptional activation. The Journal of Neuroscience 2007 27 23 6128 6140 2-s2.0-34250026412 10.1523/JNEUROSCI.0296-07.2007 (Pubitemid 46890024)
    • (2007) Journal of Neuroscience , vol.27 , Issue.23 , pp. 6128-6140
    • Vecsey, C.G.1    Hawk, J.D.2    Lattal, K.M.3    Stein, J.M.4    Fabian, S.A.5    Attner, M.A.6    Cabrera, S.M.7    McDonough, C.B.8    Brindle, P.K.9    Abel, T.10    Wood, M.A.11
  • 17
    • 84876711253 scopus 로고    scopus 로고
    • Voxel-based classification of FDG PET in dementia using inter-scanner normalization
    • 2-s2.0-84876711253 10.1016/j.neuroimage.2013.03.031
    • Thiele F., Young S., Buchert R., Wenzel F., Voxel-based classification of FDG PET in dementia using inter-scanner normalization. NeuroImage 2013 77 62 69 2-s2.0-84876711253 10.1016/j.neuroimage.2013.03.031
    • (2013) NeuroImage , vol.77 , pp. 62-69
    • Thiele, F.1    Young, S.2    Buchert, R.3    Wenzel, F.4
  • 18
    • 33645357786 scopus 로고    scopus 로고
    • Sustained hippocampal chromatin regulation in a mouse model of depression and antidepressant action
    • 2-s2.0-33645357786 10.1038/nn1659
    • Tsankova N. M., Berton O., Renthal W., Kumar A., Neve R. L., Nestler E. J., Sustained hippocampal chromatin regulation in a mouse model of depression and antidepressant action. Nature Neuroscience 2006 9 4 519 525 2-s2.0-33645357786 10.1038/nn1659
    • (2006) Nature Neuroscience , vol.9 , Issue.4 , pp. 519-525
    • Tsankova, N.M.1    Berton, O.2    Renthal, W.3    Kumar, A.4    Neve, R.L.5    Nestler, E.J.6
  • 20
    • 77952888035 scopus 로고    scopus 로고
    • Valproic acid stimulates clusterin expression in human astrocytes: Implications for Alzheimer's disease
    • 2-s2.0-77952888035 10.1016/j.neulet.2010.03.041
    • Nuutinen T., Suuronen T., Kauppinen A., Salminen A., Valproic acid stimulates clusterin expression in human astrocytes: implications for Alzheimer's disease. Neuroscience Letters 2010 475 2 64 68 2-s2.0-77952888035 10.1016/j.neulet.2010.03.041
    • (2010) Neuroscience Letters , vol.475 , Issue.2 , pp. 64-68
    • Nuutinen, T.1    Suuronen, T.2    Kauppinen, A.3    Salminen, A.4
  • 21
    • 82155182012 scopus 로고    scopus 로고
    • SAHA decreases HDAC 2 and 4 levels in vivo and improves molecular phenotypes in the R6/2 mouse model of Huntington's disease
    • 2-s2.0-82155182012 10.1371/journal.pone.0027746 e27746
    • Mielcarek M., Benn C. L., Franklin S. A., Smith D. L., Woodman B., Marks P. A., Bates G. P., SAHA decreases HDAC 2 and 4 levels in vivo and improves molecular phenotypes in the R6/2 mouse model of Huntington's disease. PLoS ONE 2011 6 11 2-s2.0-82155182012 10.1371/journal.pone.0027746 e27746
    • (2011) PLoS ONE , vol.6 , Issue.11
    • Mielcarek, M.1    Benn, C.L.2    Franklin, S.A.3    Smith, D.L.4    Woodman, B.5    Marks, P.A.6    Bates, G.P.7
  • 22
    • 34248523169 scopus 로고    scopus 로고
    • Recovery of learning and memory is associated with chromatin remodelling
    • DOI 10.1038/nature05772, PII NATURE05772
    • Fischer A., Sananbenesi F., Wang X., Dobbin M., Tsai L.-H., Recovery of learning and memory is associated with chromatin remodelling. Nature 2007 447 7141 178 182 2-s2.0-34248523169 10.1038/nature05772 (Pubitemid 46763080)
    • (2007) Nature , vol.447 , Issue.7141 , pp. 178-182
    • Fischer, A.1    Sananbenesi, F.2    Wang, X.3    Dobbin, M.4    Tsai, L.-H.5
  • 24
    • 84880533871 scopus 로고    scopus 로고
    • Drug design for neuropathic pain regulation from traditional Chinese medicine
    • 2-s2.0-84880533871
    • Tou W. I., Chang S. S., Lee C. C., Chen C. Y., Drug design for neuropathic pain regulation from traditional Chinese medicine. Scientific reports 2013 3 844 2-s2.0-84880533871
    • (2013) Scientific Reports , vol.3 , pp. 844
    • Tou, W.I.1    Chang, S.S.2    Lee, C.C.3    Chen, C.Y.4
  • 25
    • 84878775187 scopus 로고    scopus 로고
    • A novel integrated framework and improved methodology of computer-aided drug design
    • 2-s2.0-84878775187 10.2174/1568026611313090002
    • Chen C. Y., A novel integrated framework and improved methodology of computer-aided drug design. Current Topics in Medicinal Chemistry 2013 13 9 965 988 2-s2.0-84878775187 10.2174/1568026611313090002
    • (2013) Current Topics in Medicinal Chemistry , vol.13 , Issue.9 , pp. 965-988
    • Chen, C.Y.1
  • 26
    • 84884586690 scopus 로고    scopus 로고
    • How to design a drug for the disordered proteins?
    • 2-s2.0-84877740191 10.1016/j.drudis.2013.04.008
    • Chen C. Y., Tou W. I., How to design a drug for the disordered proteins? Drug Discovery Today 2013 18 19-20 910 915 2-s2.0-84877740191 10.1016/j.drudis.2013.04.008
    • (2013) Drug Discovery Today , vol.18 , Issue.19-20 , pp. 910-915
    • Chen, C.Y.1    Tou, W.I.2
  • 27
    • 84876858007 scopus 로고    scopus 로고
    • Recent developments and future directions at current computer aided drug design
    • 2-s2.0-84876858007
    • Basak S. C., Recent developments and future directions at current computer aided drug design. Current Computer-Aided Drug Design 2013 9 1 1 2-s2.0-84876858007
    • (2013) Current Computer-Aided Drug Design , vol.9 , Issue.1 , pp. 1
    • Basak, S.C.1
  • 28
    • 70349903395 scopus 로고    scopus 로고
    • Weighted equation and rules - A novel concept for evaluating protein-ligand interaction
    • 2-s2.0-70349903395
    • Chen C. Y., Weighted equation and rules-a novel concept for evaluating protein-ligand interaction. Journal of Biomolecular Structure and Dynamics 2009 27 3 271 282 2-s2.0-70349903395
    • (2009) Journal of Biomolecular Structure and Dynamics , vol.27 , Issue.3 , pp. 271-282
    • Chen, C.Y.1
  • 29
    • 85045859538 scopus 로고    scopus 로고
    • Personalized medicine: A paradigm shift in healthcare
    • 2-s2.0-84873509576 10.1016/j.biomed.2012.12.005
    • Liao W.-L., Tsai F.-J., Personalized medicine: a paradigm shift in healthcare. BioMedicine 2013 3 2 66 72 2-s2.0-84873509576 10.1016/j.biomed.2012. 12.005
    • (2013) BioMedicine , vol.3 , Issue.2 , pp. 66-72
    • Liao, W.-L.1    Tsai, F.-J.2
  • 30
    • 84893752693 scopus 로고    scopus 로고
    • Increased incidence of Parkinsonism among Chinese with β -glucosidase mutation in central Taiwan
    • Lee C. C., Tsai C. H., Wan L., Increased incidence of Parkinsonism among Chinese with β -glucosidase mutation in central Taiwan. BioMedicine 2013 3 2 92 94
    • (2013) BioMedicine , vol.3 , Issue.2 , pp. 92-94
    • Lee, C.C.1    Tsai, C.H.2    Wan, L.3
  • 31
    • 85045857873 scopus 로고    scopus 로고
    • Möbius syndrome in a male with XX/XY mosaicism
    • Chou I. -C., Lin W. -D., Wang H. -C., Möbius syndrome in a male with XX/XY mosaicism. BioMedicine 2013 3 2 102 104
    • (2013) BioMedicine , vol.3 , Issue.2 , pp. 102-104
    • Chou, I.-C.1    Lin, W.-D.2    Wang, H.-C.3
  • 32
    • 79251561193 scopus 로고    scopus 로고
    • TCM database@Taiwan: The world's largest traditional Chinese medicine database for drug screening in silico
    • 2-s2.0-79251561193 10.1371/journal.pone.0015939 e15939
    • Chen C. Y., TCM database@Taiwan: the world's largest traditional Chinese medicine database for drug screening in silico. PLoS ONE 2011 6 1 2-s2.0-79251561193 10.1371/journal.pone.0015939 e15939
    • (2011) PLoS ONE , vol.6 , Issue.1
    • Chen, C.Y.1
  • 34
    • 77955772552 scopus 로고    scopus 로고
    • Insights into designing the dual-targeted HER2/HSP90 inhibitors
    • 2-s2.0-77955772552 10.1016/j.jmgm.2010.04.002
    • Chen C. Y., Insights into designing the dual-targeted HER2/HSP90 inhibitors. Journal of Molecular Graphics and Modelling 2010 29 1 21 31 2-s2.0-77955772552 10.1016/j.jmgm.2010.04.002
    • (2010) Journal of Molecular Graphics and Modelling , vol.29 , Issue.1 , pp. 21-31
    • Chen, C.Y.1
  • 35
    • 79953746295 scopus 로고    scopus 로고
    • Stroke prevention by traditional Chinese medicine? A genetic algorithm, support vector machine and molecular dynamics approach
    • 2-s2.0-79953746295 10.1039/c0sm01548b
    • Chen K. C., Chen C. Y.-C., Stroke prevention by traditional Chinese medicine? A genetic algorithm, support vector machine and molecular dynamics approach. Soft Matter 2011 7 8 4001 4008 2-s2.0-79953746295 10.1039/c0sm01548b
    • (2011) Soft Matter , vol.7 , Issue.8 , pp. 4001-4008
    • Chen, K.C.1    Chen, C.Y.-C.2
  • 37
    • 84893792231 scopus 로고    scopus 로고
    • Pharmacological chaperone design for reducing risk factor of Parkinson's disease from traditional Chinese medicine
    • 830490 10.1155/2014/830490
    • Huang H.-J., Lee C.-C., Chen C. Y.-C., Pharmacological chaperone design for reducing risk factor of Parkinson's disease from traditional Chinese medicine. Evidence-Based Complementary and Alternative Medicine 2014 2014 12 830490 10.1155/2014/830490
    • (2014) Evidence-Based Complementary and Alternative Medicine , vol.2014 , pp. 12
    • Huang, H.-J.1    Lee, C.-C.2    Chen, C.Y.-C.3
  • 38
    • 84896690448 scopus 로고    scopus 로고
    • Discovery of novel insomnia leads from screening traditional Chinese medicine database
    • 10.1080/07391102.2013.790849
    • Chen H. Y., Chang S. S., Chan Y. C., Chen C. Y., Discovery of novel insomnia leads from screening traditional Chinese medicine database. Journal of Biomolecular Structure & Dynamics 2014 32 5 776 791 10.1080/07391102.2013. 790849
    • (2014) Journal of Biomolecular Structure & Dynamics , vol.32 , Issue.5 , pp. 776-791
    • Chen, H.Y.1    Chang, S.S.2    Chan, Y.C.3    Chen, C.Y.4
  • 39
    • 84896071801 scopus 로고    scopus 로고
    • Investigation of the novel lead of melanocortin 1 receptor for pigmentary disorders
    • 254678 10.1155/2014/254678
    • Tang H.-C., Chen C. Y.-C., Investigation of the novel lead of melanocortin 1 receptor for pigmentary disorders. Evidence-Based Complementary and Alternative Medicine 2014 2014 13 254678 10.1155/2014/254678
    • (2014) Evidence-Based Complementary and Alternative Medicine , vol.2014 , pp. 13
    • Tang, H.-C.1    Chen, C.Y.-C.2
  • 40
    • 80755182421 scopus 로고    scopus 로고
    • High performance screening, structural and molecular dynamics analysis to identify H1 inhibitors from TCM database@Taiwan
    • 2-s2.0-80755182421 10.1039/c1mb05320e
    • Chang S.-S., Huang H.-J., Chen C. Y., High performance screening, structural and molecular dynamics analysis to identify H1 inhibitors from TCM database@Taiwan. Molecular BioSystems 2011 7 12 3366 3374 2-s2.0-80755182421 10.1039/c1mb05320e
    • (2011) Molecular BioSystems , vol.7 , Issue.12 , pp. 3366-3374
    • Chang, S.-S.1    Huang, H.-J.2    Chen, C.Y.3
  • 41
    • 78650945927 scopus 로고    scopus 로고
    • Potent inhibitor design against H1N1 swine influenza: Structure-based and molecular dynamics analysis for M2 inhibitors from traditional Chinese medicine database
    • 2-s2.0-78650945927
    • Lin C. H., Chang T. T., Sun M. F., Chen H. Y., Tsai F. J., Chang K. L., Fisher M., Chen C. Y.-C., Potent inhibitor design against H1N1 swine influenza: structure-based and molecular dynamics analysis for M2 inhibitors from traditional Chinese medicine database. Journal of Biomolecular Structure and Dynamics 2011 28 4 471 482 2-s2.0-78650945927
    • (2011) Journal of Biomolecular Structure and Dynamics , vol.28 , Issue.4 , pp. 471-482
    • Lin, C.H.1    Chang, T.T.2    Sun, M.F.3    Chen, H.Y.4    Tsai, F.J.5    Chang, K.L.6    Fisher, M.7    Chen, C.Y.-C.8
  • 42
    • 84855282742 scopus 로고    scopus 로고
    • Two birds with one stone? Possible dual-targeting H1N1 inhibitors from traditional Chinese medicine
    • 2-s2.0-84855282742 10.1371/journal.pcbi.1002315 e1002315
    • Chang S. S., Huang H. J., Chen C. Y.-C., Two birds with one stone? Possible dual-targeting H1N1 inhibitors from traditional Chinese medicine. PLoS Computational Biology 2011 7 12 2-s2.0-84855282742 10.1371/journal.pcbi.1002315 e1002315
    • (2011) PLoS Computational Biology , vol.7 , Issue.12
    • Chang, S.S.1    Huang, H.J.2    Chen, C.Y.-C.3
  • 44
    • 84889688897 scopus 로고    scopus 로고
    • Traditional Chinese medicine application in HIV: An in silico study
    • 10.1080/07391102.2012.745168
    • Huang H. J., Jian Y. R., Chen C. Y., Traditional Chinese medicine application in HIV: an in silico study. Journal of Biomolecular Structure & Dynamics 2014 32 1 1 12 10.1080/07391102.2012.745168
    • (2014) Journal of Biomolecular Structure & Dynamics , vol.32 , Issue.1 , pp. 1-12
    • Huang, H.J.1    Jian, Y.R.2    Chen, C.Y.3
  • 45
    • 80051545693 scopus 로고    scopus 로고
    • IScreen: World's first cloud-computing web server for virtual screening and de novo drug design based on TCM database@Taiwan
    • 2-s2.0-80051545693 10.1007/s10822-011-9438-9
    • Tsai T. Y., Chang K. W., Chen C. Y., iScreen: world's first cloud-computing web server for virtual screening and de novo drug design based on TCM database@Taiwan. Journal of Computer-Aided Molecular Design 2011 25 6 525 531 2-s2.0-80051545693 10.1007/s10822-011-9438-9
    • (2011) Journal of Computer-Aided Molecular Design , vol.25 , Issue.6 , pp. 525-531
    • Tsai, T.Y.1    Chang, K.W.2    Chen, C.Y.3
  • 49
    • 0037212102 scopus 로고    scopus 로고
    • LigandFit: A novel method for the shape-directed rapid docking of ligands to protein active sites
    • DOI 10.1016/S1093-3263(02)00164-X, PII S109332630200164X
    • Venkatachalam C. M., Jiang X., Oldfield T., Waldman M., LigandFit: a novel method for the shape-directed rapid docking of ligands to protein active sites. Journal of Molecular Graphics and Modelling 2003 21 4 289 307 2-s2.0-0037212102 10.1016/S1093-3263(02)00164-X (Pubitemid 35441326)
    • (2003) Journal of Molecular Graphics and Modelling , vol.21 , Issue.4 , pp. 289-307
    • Venkatachalam, C.M.1    Jiang, X.2    Oldfield, T.3    Waldman, M.4
  • 51
    • 79955702502 scopus 로고    scopus 로고
    • LIBSVM: A library for support vector machines
    • ARTICLE 27 2-s2.0-79955702502 10.1145/1961189.1961199
    • Chang C. C., Lin C. J., LIBSVM: a library for support vector machines. ACM Transactions on Intelligent Systems and Technology 2011 2 3, article 27 2-s2.0-79955702502 10.1145/1961189.1961199
    • (2011) ACM Transactions on Intelligent Systems and Technology , vol.2 , Issue.3
    • Chang, C.C.1    Lin, C.J.2
  • 53
    • 0028467707 scopus 로고
    • Application of genetic function approximation to quantitative structure-activity relationships and quantitative structure-property relationships
    • 2-s2.0-0028467707
    • Rogers D., Hopfinger A. J., Application of genetic function approximation to quantitative structure-activity relationships and quantitative structure-property relationships. Journal of Chemical Information and Computer Sciences 1994 34 4 854 866 2-s2.0-0028467707
    • (1994) Journal of Chemical Information and Computer Sciences , vol.34 , Issue.4 , pp. 854-866
    • Rogers, D.1    Hopfinger, A.J.2
  • 54
    • 79958841703 scopus 로고    scopus 로고
    • SwissParam: A fast force field generation tool for small organic molecules
    • 2-s2.0-79958841703 10.1002/jcc.21816
    • Zoete V., Cuendet M. A., Grosdidier A., Michielin O., SwissParam: a fast force field generation tool for small organic molecules. Journal of Computational Chemistry 2011 32 11 2359 2368 2-s2.0-79958841703 10.1002/jcc.21816
    • (2011) Journal of Computational Chemistry , vol.32 , Issue.11 , pp. 2359-2368
    • Zoete, V.1    Cuendet, M.A.2    Grosdidier, A.3    Michielin, O.4
  • 55
    • 84901039445 scopus 로고    scopus 로고
    • Comparison of the CHARMM27, AMBER4.1 and BMS nucleic acid force fields via free energy calculations of base flipping
    • Priyakumar U. D., MacKerell A. D., Comparison of the CHARMM27, AMBER4.1 and BMS nucleic acid force fields via free energy calculations of base flipping. Abstracts of Papers of the American Chemical Society 2005 230 U1391 U1392
    • (2005) Abstracts of Papers of the American Chemical Society , vol.230
    • Priyakumar, U.D.1    Mackerell, A.D.2
  • 56
    • 46249092554 scopus 로고    scopus 로고
    • GRGMACS 4: Algorithms for highly efficient, load-balanced, and scalable molecular simulation
    • 2-s2.0-46249092554 10.1021/ct700301q
    • Hess B., Kutzner C., van der Spoel D., Lindahl E., GRGMACS 4: algorithms for highly efficient, load-balanced, and scalable molecular simulation. Journal of Chemical Theory and Computation 2008 4 3 435 447 2-s2.0-46249092554 10.1021/ct700301q
    • (2008) Journal of Chemical Theory and Computation , vol.4 , Issue.3 , pp. 435-447
    • Hess, B.1    Kutzner, C.2    Van Der Spoel, D.3    Lindahl, E.4
  • 57
    • 0027359241 scopus 로고
    • Molecular modeling: An experimental tool
    • Darden T. A., Pedersen L. G., Molecular modeling: an experimental tool. Environmental Health Perspectives 1993 101 5 410 412 2-s2.0-0027359241 (Pubitemid 23343688)
    • (1993) Environmental Health Perspectives , vol.101 , Issue.5 , pp. 410-412
    • Darden, T.A.1    Pedersen, L.G.2
  • 58
    • 80054911951 scopus 로고    scopus 로고
    • LigPlot+: Multiple ligand-protein interaction diagrams for drug discovery
    • 2-s2.0-80054911951 10.1021/ci200227u
    • Laskowski R. A., Swindells M. B., LigPlot+: multiple ligand-protein interaction diagrams for drug discovery. Journal of Chemical Information and Modeling 2011 51 10 2778 2786 2-s2.0-80054911951 10.1021/ci200227u
    • (2011) Journal of Chemical Information and Modeling , vol.51 , Issue.10 , pp. 2778-2786
    • Laskowski, R.A.1    Swindells, M.B.2


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