{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2025,10,23]],"date-time":"2025-10-23T16:35:10Z","timestamp":1761237310856},"reference-count":28,"publisher":"Springer Science and Business Media LLC","issue":"2","license":[{"start":{"date-parts":[[2006,2,1]],"date-time":"2006-02-01T00:00:00Z","timestamp":1138752000000},"content-version":"tdm","delay-in-days":0,"URL":"http:\/\/www.springer.com\/tdm"}],"content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["J Comput Aided Mol Des"],"published-print":{"date-parts":[[2006,2]]},"DOI":"10.1007\/s10822-006-9038-2","type":"journal-article","created":{"date-parts":[[2006,5,8]],"date-time":"2006-05-08T15:08:24Z","timestamp":1147100904000},"page":"83-95","source":"Crossref","is-referenced-by-count":32,"title":["Investigation of substituent effect of 1-(3,3-diphenylpropyl)-piperidinyl phenylacetamides on CCR5 binding affinity using QSAR and virtual screening techniques"],"prefix":"10.1007","volume":"20","author":[{"given":"Antreas","family":"Afantitis","sequence":"first","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Georgia","family":"Melagraki","sequence":"additional","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Haralambos","family":"Sarimveis","sequence":"additional","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Panayiotis A.","family":"Koutentis","sequence":"additional","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"John","family":"Markopoulos","sequence":"additional","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Olga","family":"Igglessi-Markopoulou","sequence":"additional","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]}],"member":"297","published-online":{"date-parts":[[2006,5,9]]},"reference":[{"key":"9038_CR1","doi-asserted-by":"crossref","first-page":"25","DOI":"10.1016\/j.bmcl.2004.10.044","volume":"15","author":"J.N. Burrows","year":"2005","unstructured":"Burrows J.N., Cumming J.G., Fillery S.M., Hamlin G.A., Hudson J.A., Jackson R.J., McLaughlin S., Shaw J.S., (2005) Bioorg. Med. Chem. Lett. 15: 25","journal-title":"Bioorg. Med. Chem. Lett."},{"key":"9038_CR2","doi-asserted-by":"crossref","first-page":"2663","DOI":"10.1016\/S0968-0896(03)00161-5","volume":"11","author":"W. Kazmierski","year":"2003","unstructured":"Kazmierski W., Bifoulco N., Yang H., Boone L., DeAnda F., Watson C., Kenakin T., (2003) Bioorg. Med. Chem. 11: 2663","journal-title":"Bioorg. Med. Chem."},{"key":"9038_CR3","first-page":"9","volume":"2","author":"N. Pipitone","year":"2000","unstructured":"Pipitone N., Pitzalis C., (2000) Curr. Opin. Anti-inflammat. Immunomodulat. Invset. Drugs 2: 9","journal-title":"Curr. Opin. Anti-inflammat. Immunomodulat. Invset. Drugs"},{"key":"9038_CR4","doi-asserted-by":"crossref","first-page":"98","DOI":"10.1016\/S0165-5728(99)00166-6","volume":"102","author":"F. Sellebjerg","year":"2000","unstructured":"Sellebjerg F., Madsen H.O., Jensen C.V., Jensen J., Garred P.J, (2000) J. Neuroimmunol. 102: 98","journal-title":"J. Neuroimmunol."},{"key":"9038_CR5","doi-asserted-by":"crossref","first-page":"1758","DOI":"10.1016\/S0140-6736(00)04898-4","volume":"387","author":"M. Fischereder","year":"2001","unstructured":"Fischereder M., Luckow B., Wuthrich R.P., Rothenpieler U., Schneeberger H., Panzer U., Stahl R.A.K., Hauser I.A, Budde K., Neumayer H.-H., Kramer B.K., Land W., Schlondorff D., (2001) Lancet 387: 1758","journal-title":"Lancet"},{"key":"9038_CR6","doi-asserted-by":"crossref","first-page":"6303","DOI":"10.4049\/jimmunol.164.12.6303","volume":"164","author":"P.G. Andres","year":"2000","unstructured":"Andres P.G., Beck P.L., Mizoguchi E., Mizoguchi A., Bhan A.K., Dawson T., Kuziel W.A., Maeda N., MacDermott N., Podolsky R.P, Reinecker D.K., (2000) J. Immunol. 164: 6303","journal-title":"J.\u2423Immunol."},{"key":"9038_CR7","doi-asserted-by":"crossref","first-page":"4501","DOI":"10.1021\/jm030265z","volume":"46","author":"A.K. Debnath","year":"2003","unstructured":"Debnath A.K., (2003) J. Med. Chem. 46: 4501","journal-title":"J. Med. Chem."},{"key":"9038_CR8","doi-asserted-by":"crossref","first-page":"6193","DOI":"10.1016\/j.bmc.2004.08.045","volume":"12","author":"Y. Xu","year":"2004","unstructured":"Xu Y., Liu H., Niu C., Luo C., Shen J., Chen K., Jiang H., (2004) Bioorg. Med. Chem. 12: 6193","journal-title":"Bioorg. Med. Chem."},{"key":"9038_CR9","doi-asserted-by":"crossref","first-page":"489","DOI":"10.1016\/j.bmc.2003.10.019","volume":"12","author":"M. Song","year":"2004","unstructured":"Song M., Breneman C.M., Sukumar N., (2004) Bioorg. Med. Chem. 12: 489","journal-title":"Bioorg. Med. Chem."},{"key":"9038_CR10","doi-asserted-by":"crossref","first-page":"387","DOI":"10.1002\/qsar.200430871","volume":"23","author":"J.T. Leonard","year":"2004","unstructured":"Leonard J.T., Roy K., (2004) QSAR Comb. Sci. 23: 387","journal-title":"QSAR Comb. Sci."},{"key":"9038_CR11","doi-asserted-by":"crossref","first-page":"1352","DOI":"10.1021\/ci050205x","volume":"45","author":"K. Roy","year":"2005","unstructured":"Roy K., Leonard J.T., (2005) J. Chem. Inf. Model. 45: 1352","journal-title":"J. Chem. Inf. Model."},{"key":"9038_CR12","unstructured":"Todeschini, R., Consonni, V., Mannhold, R. (Series Editor), Kubinyi, H. (Series Editor) and Timmerman, H. (Series Editor), Handbook of Molecular Descriptors, Wiley-VCH, Weinheim, 2000"},{"key":"9038_CR13","unstructured":"Efroymson, M.A., In Ralston, A. and Wilf, H.S. (Eds.), Mathematical Methods for Digital Computers, Wiley, NY, 1960"},{"key":"9038_CR14","doi-asserted-by":"crossref","first-page":"316","DOI":"10.1080\/01621459.1983.10477973","volume":"78","author":"B. Efron","year":"1983","unstructured":"Efron B., (1983) J. Am. Stat. Assoc., 78: 316","journal-title":"J. Am. Stat. Assoc."},{"key":"9038_CR15","doi-asserted-by":"crossref","first-page":"39","DOI":"10.1002\/cem.1180020106","volume":"2","author":"D.W. Osten","year":"1998","unstructured":"Osten D.W., (1998) J. Chemom. 2: 39","journal-title":"J. Chemom."},{"key":"9038_CR16","unstructured":"Wold, S. and Eriksson, L., In Van de Waterbeemd, H. (Ed.), Chemometrics Methods In Molecular Design, VCH Weinheim, Germany, 1995"},{"key":"9038_CR17","doi-asserted-by":"crossref","first-page":"1","DOI":"10.1002\/qsar.200390007","volume":"22","author":"A. Tropsha","year":"2003","unstructured":"Tropsha A., Gramatica P., Gombar V.K., (2003) QSAR Comb. Sci. 22: 1","journal-title":"QSAR Comb. Sci."},{"key":"9038_CR18","doi-asserted-by":"crossref","first-page":"269","DOI":"10.1016\/S1093-3263(01)00123-1","volume":"20","author":"A. Golbraikh","year":"2002","unstructured":"Golbraikh A., Tropsha A., (2002) J. Mol. Graph. Mod. 20: 269","journal-title":"J. Mol. Graph. Mod."},{"key":"9038_CR19","doi-asserted-by":"crossref","first-page":"2356","DOI":"10.1021\/jm030584q","volume":"47","author":"M. Shen","year":"2004","unstructured":"Shen M., Beguin C., Golbraikh A., Stables J., Kohn H., Tropsha A., (2004) J. Med. Chem. 47: 2356","journal-title":"J. Med. Chem."},{"key":"9038_CR20","volume-title":"Plots, Transformations and Regression","author":"A. Atkinson","year":"1985","unstructured":"Atkinson A. 1985. Plots, Transformations and Regression. Clarendon Press, Oxford (UK)"},{"key":"9038_CR21","doi-asserted-by":"crossref","first-page":"384","DOI":"10.1016\/S1367-5931(99)80058-1","volume":"3","author":"W.P.A. Walters","year":"1999","unstructured":"Walters W.P.A., Murcko M.A., (1999) Curr. Opin. Chem. Biol. 3: 384","journal-title":"Curr. Opin. Chem. Biol."},{"key":"9038_CR22","unstructured":"Devillers, J. (Ed.), Comparative QSAR. Taylor and Francis, Washington, DC, 1998"},{"key":"9038_CR23","volume-title":"Exploring QSAR: Fundamentals and Applications in Chemistry and Biology","author":"C. Hansch","year":"1995","unstructured":"Hansch C., Leo A., 1995. Exploring QSAR: Fundamentals and Applications in Chemistry and Biology. ACS, Washington, DC"},{"key":"9038_CR24","doi-asserted-by":"crossref","first-page":"1108","DOI":"10.1016\/j.bmc.2005.09.038","volume":"14","author":"G. Melagraki","year":"2006","unstructured":"Melagraki G., Afantitis A., Sarimveis H., Igglessi-Markopoulou O., Supuran C.T, (2006). Bioorg. Med. Chem. 14: 1108","journal-title":"Bioorg. Med. Chem."},{"key":"9038_CR25","unstructured":"Melagraki, G., Afantitis, \u0391., Sarimveis, H., Igglessi-Markopoulou, O. and Alexandridis, A., Mol. Div. (2006) In Press ID AP_11030_2005_9008"},{"key":"9038_CR26","doi-asserted-by":"crossref","first-page":"231","DOI":"10.1023\/A:1021372108686","volume":"5","author":"A. Golbraikh","year":"2000","unstructured":"Golbraikh A., Tropsha A., (2000) Mol. Div. 5: 231","journal-title":"Mol. Div."},{"key":"9038_CR27","doi-asserted-by":"crossref","first-page":"385","DOI":"10.1002\/qsar.200430909","volume":"24","author":"A.O. Aptula","year":"2005","unstructured":"Aptula A.O., Jeliazkova N.G., Schultz T.W., Cronin M.T.D., (2005) QSAR Comb. Sci. 24: 385","journal-title":"QSAR Comb. Sci."},{"key":"9038_CR28","unstructured":"Afantitis, \u0391., Melagraki, G., Sarimveis, H., Koutentis, P.A., Markopoulos, J. and Igglessi-Markopoulou, O., Mol. Div. (2006) In Press DOI MODI28R2"}],"container-title":["Journal of Computer-Aided Molecular Design"],"original-title":[],"language":"en","link":[{"URL":"http:\/\/link.springer.com\/content\/pdf\/10.1007\/s10822-006-9038-2.pdf","content-type":"application\/pdf","content-version":"vor","intended-application":"text-mining"},{"URL":"http:\/\/link.springer.com\/article\/10.1007\/s10822-006-9038-2\/fulltext.html","content-type":"text\/html","content-version":"vor","intended-application":"text-mining"},{"URL":"http:\/\/link.springer.com\/content\/pdf\/10.1007\/s10822-006-9038-2","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2019,5,31]],"date-time":"2019-05-31T01:22:53Z","timestamp":1559265773000},"score":1,"resource":{"primary":{"URL":"http:\/\/link.springer.com\/10.1007\/s10822-006-9038-2"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2006,2]]},"references-count":28,"journal-issue":{"issue":"2","published-print":{"date-parts":[[2006,2]]}},"alternative-id":["9038"],"URL":"https:\/\/doi.org\/10.1007\/s10822-006-9038-2","relation":{},"ISSN":["0920-654X","1573-4951"],"issn-type":[{"value":"0920-654X","type":"print"},{"value":"1573-4951","type":"electronic"}],"subject":[],"published":{"date-parts":[[2006,2]]}}}