{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,3,11]],"date-time":"2026-03-11T09:42:26Z","timestamp":1773222146997,"version":"3.50.1"},"reference-count":65,"publisher":"Springer Science and Business Media LLC","issue":"11","license":[{"start":{"date-parts":[[2013,11,1]],"date-time":"2013-11-01T00:00:00Z","timestamp":1383264000000},"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":[[2013,11]]},"DOI":"10.1007\/s10822-013-9693-z","type":"journal-article","created":{"date-parts":[[2013,11,21]],"date-time":"2013-11-21T03:42:10Z","timestamp":1385005330000},"page":"965-974","source":"Crossref","is-referenced-by-count":73,"title":["A computational analysis of binding modes and conformation changes of MDM2 induced by p53 and inhibitor bindings"],"prefix":"10.1007","volume":"27","author":[{"given":"Jianzhong","family":"Chen","sequence":"first","affiliation":[]},{"given":"Jinan","family":"Wang","sequence":"additional","affiliation":[]},{"given":"Weiliang","family":"Zhu","sequence":"additional","affiliation":[]},{"given":"Guohui","family":"Li","sequence":"additional","affiliation":[]}],"member":"297","published-online":{"date-parts":[[2013,11,22]]},"reference":[{"issue":"17","key":"9693_CR1","doi-asserted-by":"crossref","first-page":"2899","DOI":"10.1038\/sj.onc.1208615","volume":"24","author":"SL Harris","year":"2005","unstructured":"Harris SL, Levine AJ (2005) Oncogene 24(17):2899","journal-title":"Oncogene"},{"issue":"56","key":"9693_CR2","doi-asserted-by":"crossref","first-page":"9030","DOI":"10.1038\/sj.onc.1207116","volume":"22","author":"JS Fridman","year":"2003","unstructured":"Fridman JS, Lowe SW (2003) Oncogene 22(56):9030","journal-title":"Oncogene"},{"issue":"17","key":"9693_CR3","doi-asserted-by":"crossref","first-page":"5001","DOI":"10.1093\/emboj\/17.17.5001","volume":"17","author":"FJ Stott","year":"1998","unstructured":"Stott FJ, Bates S, James MC, McConnell BB, Starborg M, Brookes S, Palmero I, Ryan K, Hara E, Vousden KH (1998) EMBO J 17(17):5001","journal-title":"EMBO J"},{"issue":"7","key":"9693_CR4","doi-asserted-by":"crossref","first-page":"1805","DOI":"10.1093\/emboj\/18.7.1805","volume":"18","author":"T Unger","year":"1999","unstructured":"Unger T, Juven-Gershon T, Moallem E, Berger M, Sionov RV, Lozano G, Oren M, Haupt Y (1999) EMBO J 18(7):1805","journal-title":"EMBO J"},{"issue":"3","key":"9693_CR5","doi-asserted-by":"crossref","first-page":"370","DOI":"10.1093\/emboj\/19.3.370","volume":"19","author":"PV Nikolova","year":"2000","unstructured":"Nikolova PV, Wong KB, DeDecker B, Henckel J, Fersht AR (2000) EMBO J 19(3):370","journal-title":"EMBO J"},{"issue":"4","key":"9693_CR6","doi-asserted-by":"crossref","first-page":"275","DOI":"10.1038\/nrm2147","volume":"8","author":"KH Vousden","year":"2007","unstructured":"Vousden KH, Lane DP (2007) Nat Rev Mol Cell Biol 8(4):275","journal-title":"Nat Rev Mol Cell Biol"},{"issue":"5289","key":"9693_CR7","doi-asserted-by":"crossref","first-page":"948","DOI":"10.1126\/science.274.5289.948","volume":"274","author":"PH Kussie","year":"1996","unstructured":"Kussie PH, Gorina S, Marechal V, Elenbaas B, Moreau J, Levine AJ, Pavletich NP (1996) Science 274(5289):948","journal-title":"Science"},{"issue":"10","key":"9693_CR8","doi-asserted-by":"crossref","first-page":"2930","DOI":"10.1021\/ja0678774","volume":"129","author":"HF Chen","year":"2007","unstructured":"Chen HF, Luo R (2007) J Am Chem Soc 129(10):2930","journal-title":"J Am Chem Soc"},{"issue":"19","key":"9693_CR9","doi-asserted-by":"crossref","first-page":"2386","DOI":"10.4161\/cc.6.19.4740","volume":"6","author":"GM Popowicz","year":"2007","unstructured":"Popowicz GM, Czarna A, Rothweiler U, Szwagierczak A, Krajewski M, Weber L, Holak TA (2007) Cell Cycle 6(19):2386","journal-title":"Cell Cycle"},{"issue":"14","key":"9693_CR10","first-page":"1001","volume":"1","author":"UM Moll","year":"2003","unstructured":"Moll UM, Petrenko O (2003) Mol Cancer Res 1(14):1001","journal-title":"Mol Cancer Res"},{"issue":"46","key":"9693_CR11","doi-asserted-by":"crossref","first-page":"38795","DOI":"10.1074\/jbc.M508578200","volume":"280","author":"SW Chi","year":"2005","unstructured":"Chi SW, Lee SH, Kim DH, Ahn MJ, Kim JS, Woo JY, Torizawa T, Kainosho M, Han KH (2005) J Biol Chem 280(46):38795","journal-title":"J Biol Chem"},{"issue":"2","key":"9693_CR12","doi-asserted-by":"crossref","first-page":"102","DOI":"10.1038\/nrc991","volume":"3","author":"P Ch\u00e8ne","year":"2003","unstructured":"Ch\u00e8ne P (2003) Nat Rev Cancer 3(2):102","journal-title":"Nat Rev Cancer"},{"issue":"8","key":"9693_CR13","doi-asserted-by":"crossref","first-page":"1415","DOI":"10.1038\/sj.bjc.6602164","volume":"91","author":"C Klein","year":"2004","unstructured":"Klein C, Vassilev L (2004) Br J Cancer 91(8):1415","journal-title":"Br J Cancer"},{"issue":"33","key":"9693_CR14","doi-asserted-by":"crossref","first-page":"12165","DOI":"10.1073\/pnas.0402283101","volume":"101","author":"E Gr\u00f6nroos","year":"2004","unstructured":"Gr\u00f6nroos E, Terentiev AA, Punga T, Ericsson J (2004) Proc Natl Acad Sci USA 101(33):12165","journal-title":"Proc Natl Acad Sci USA"},{"issue":"31","key":"9693_CR15","doi-asserted-by":"crossref","first-page":"9468","DOI":"10.1021\/ja031625a","volume":"126","author":"JA Kritzer","year":"2004","unstructured":"Kritzer JA, Lear JD, Hodsdon ME, Schepartz A (2004) J Am Chem Soc 126(31):9468","journal-title":"J Am Chem Soc"},{"key":"9693_CR16","doi-asserted-by":"crossref","first-page":"676","DOI":"10.1021\/ja108230s","volume":"133","author":"JH Lee","year":"2011","unstructured":"Lee JH, Zhang Q, Jo S, Chai SC, Oh M, Im W, Lu H, Lim HS (2011) J Am Chem Soc 133:676","journal-title":"J Am Chem Soc"},{"issue":"3","key":"9693_CR17","doi-asserted-by":"crossref","first-page":"2174","DOI":"10.1074\/jbc.M109.073056","volume":"285","author":"J Phan","year":"2010","unstructured":"Phan J, Li Z, Kasprzak A, Li B, Sebti S, Guida W, Sch\u00f6nbrunn E, Chen J (2010) J Biol Chem 285(3):2174","journal-title":"J Biol Chem"},{"issue":"32","key":"9693_CR18","doi-asserted-by":"crossref","first-page":"14321","DOI":"10.1073\/pnas.1008930107","volume":"107","author":"M Liu","year":"2010","unstructured":"Liu M, Li C, Pazgier M, Mao Y, Lv Y, Gu B, Wei G, Yuan W, Zhan C (2010) Proc Natl Acad Sci USA 107(32):14321","journal-title":"Proc Natl Acad Sci USA"},{"issue":"12","key":"9693_CR19","doi-asserted-by":"crossref","first-page":"4665","DOI":"10.1073\/pnas.0900947106","volume":"106","author":"M Pazgier","year":"2009","unstructured":"Pazgier M, Liu M, Zou G, Yuan W, Li C, Li J, Monbo J, Zella D, Tarasov SG (2009) Proc Natl Acad Sci USA 106(12):4665","journal-title":"Proc Natl Acad Sci USA"},{"issue":"5659","key":"9693_CR20","doi-asserted-by":"crossref","first-page":"844","DOI":"10.1126\/science.1092472","volume":"303","author":"LT Vassilev","year":"2004","unstructured":"Vassilev LT, Vu BT, Graves B, Carvajal D, Podlaski F, Filipovic Z, Kong N, Kammlott U, Lukacs C, Klein C (2004) Science 303(5659):844","journal-title":"Science"},{"issue":"21","key":"9693_CR21","doi-asserted-by":"crossref","first-page":"6209","DOI":"10.1021\/jm0601194","volume":"49","author":"IR Hardcastle","year":"2006","unstructured":"Hardcastle IR, Ahmed SU, Atkins H, Farnie G, Golding BT, Griffin RJ, Guyenne S, Hutton C, K\u00e4llblad P, Kemp SJ (2006) J Med Chem 49(21):6209","journal-title":"J Med Chem"},{"issue":"12","key":"9693_CR22","doi-asserted-by":"crossref","first-page":"3432","DOI":"10.1021\/jm051122a","volume":"49","author":"K Ding","year":"2006","unstructured":"Ding K, Lu Y, Nikolovska-Coleska Z, Wang G, Qiu S, Shangary S, Gao W, Qin D, Stuckey J, Krajewski K (2006) J Med Chem 49(12):3432","journal-title":"J Med Chem"},{"key":"9693_CR23","doi-asserted-by":"crossref","first-page":"223","DOI":"10.1146\/annurev.pharmtox.48.113006.094723","volume":"49","author":"S Shangary","year":"2009","unstructured":"Shangary S, Wang S (2009) Annu Rev Pharmacol Toxicol 49:223","journal-title":"Annu Rev Pharmacol Toxicol"},{"issue":"10","key":"9693_CR24","doi-asserted-by":"crossref","first-page":"3933","DOI":"10.1073\/pnas.0708917105","volume":"105","author":"S Shangary","year":"2008","unstructured":"Shangary S, Qin D, McEachern D, Liu M, Miller RS, Qiu S, Nikolovska-Coleska Z, Ding K, Wang G, Chen J (2008) Proc Natl Acad Sci USA 105(10):3933","journal-title":"Proc Natl Acad Sci USA"},{"issue":"4","key":"9693_CR25","doi-asserted-by":"crossref","first-page":"909","DOI":"10.1021\/jm049137g","volume":"48","author":"BL Grasberger","year":"2005","unstructured":"Grasberger BL, Lu T, Schubert C, Parks DJ, Carver TE, Koblish HK, Cummings MD, LaFrance LV, Milkiewicz KL, Calvo RR (2005) J Med Chem 48(4):909","journal-title":"J Med Chem"},{"issue":"36","key":"9693_CR26","doi-asserted-by":"crossref","first-page":"11396","DOI":"10.1021\/jp8015886","volume":"112","author":"Y Ding","year":"2008","unstructured":"Ding Y, Mei Y, Zhang JZH (2008) J Phys Chem B 112(36):11396","journal-title":"J Phys Chem B"},{"issue":"8","key":"9693_CR27","doi-asserted-by":"crossref","first-page":"687","DOI":"10.1007\/s10822-010-9366-0","volume":"24","author":"G Hu","year":"2010","unstructured":"Hu G, Wang D, Liu X, Zhang Q (2010) J Comput Aid Mol Des 24(8):687","journal-title":"J Comput Aid Mol Des"},{"key":"9693_CR28","doi-asserted-by":"crossref","first-page":"167","DOI":"10.1016\/j.jmgm.2011.07.003","volume":"30","author":"SY Lu","year":"2011","unstructured":"Lu SY, Jiang YJ, Zou JW, Wu TX (2011) J Mol Graph Model 30:167","journal-title":"J Mol Graph Model"},{"key":"9693_CR29","doi-asserted-by":"crossref","unstructured":"Chen J, Wang J, Xu B, Zhu W, Li G (2011) J Mol Graph Model\u00a030:46","DOI":"10.1016\/j.jmgm.2011.06.003"},{"issue":"36","key":"9693_CR30","doi-asserted-by":"crossref","first-page":"8133","DOI":"10.1021\/ja990935j","volume":"121","author":"I Massova","year":"1999","unstructured":"Massova I, Kollman PA (1999) J Am Chem Soc 121(36):8133","journal-title":"J Am Chem Soc"},{"issue":"1","key":"9693_CR31","doi-asserted-by":"crossref","first-page":"222","DOI":"10.1002\/prot.20275","volume":"58","author":"H Zhong","year":"2005","unstructured":"Zhong H, Carlson HA (2005) Proteins 58(1):222","journal-title":"Proteins"},{"issue":"2","key":"9693_CR32","doi-asserted-by":"crossref","first-page":"2176","DOI":"10.3390\/ijms13022176","volume":"13","author":"J Chen","year":"2012","unstructured":"Chen J, Zhang D, Zhang Y, Li G (2012) Int J Mol Sci 13(2):2176","journal-title":"Int J Mol Sci"},{"issue":"4","key":"9693_CR33","doi-asserted-by":"crossref","first-page":"365","DOI":"10.1002\/bip.20566","volume":"83","author":"L Espinoza-Fonseca","year":"2006","unstructured":"Espinoza-Fonseca L, Trujillo-Ferrara JG (2006) Biopolymers 83(4):365","journal-title":"Biopolymers"},{"issue":"3","key":"9693_CR34","doi-asserted-by":"crossref","first-page":"205","DOI":"10.1002\/prot.340110305","volume":"11","author":"T Ichiye","year":"2004","unstructured":"Ichiye T, Karplus M (2004) Proteins 11(3):205","journal-title":"Proteins"},{"issue":"6","key":"9693_CR35","doi-asserted-by":"crossref","first-page":"1099","DOI":"10.1002\/bip.360230610","volume":"23","author":"R Levy","year":"2004","unstructured":"Levy R, Srinivasan A, Olson W, McCammon J (2004) Biopolymers 23(6):1099","journal-title":"Biopolymers"},{"issue":"7","key":"9693_CR36","doi-asserted-by":"crossref","first-page":"2737","DOI":"10.1529\/biophysj.107.114942","volume":"94","author":"M Laberge","year":"2008","unstructured":"Laberge M, Yonetani T (2008) Biophys J 94(7):2737","journal-title":"Biophys J"},{"issue":"4","key":"9693_CR37","doi-asserted-by":"crossref","first-page":"412","DOI":"10.1002\/prot.340170408","volume":"17","author":"A Amadei","year":"2004","unstructured":"Amadei A, Linssen A, Berendsen HJC (2004) Proteins 17(4):412","journal-title":"Proteins"},{"issue":"11","key":"9693_CR38","doi-asserted-by":"crossref","first-page":"789","DOI":"10.1038\/nchembio.232","volume":"5","author":"DD Boehr","year":"2009","unstructured":"Boehr DD, Nussinov R, Wright PE (2009) Nat Chem Biol 5(11):789","journal-title":"Nat Chem Biol"},{"issue":"46","key":"9693_CR39","doi-asserted-by":"crossref","first-page":"15172","DOI":"10.1021\/jp104508k","volume":"114","author":"J Wang","year":"2010","unstructured":"Wang J, Yang H, Zuo Z, Yan X, Wang Y, Luo X, Jiang H, Chen K, Zhu W (2010) J Phys Chem B 114(46):15172","journal-title":"J Phys Chem B"},{"issue":"28","key":"9693_CR40","doi-asserted-by":"crossref","first-page":"8704","DOI":"10.1002\/chem.200800277","volume":"14","author":"EL Wu","year":"2008","unstructured":"Wu EL, Han KL, Zhang JZH (2008) Chem A Eur J 14(28):8704","journal-title":"Chem A Eur J"},{"issue":"3","key":"9693_CR41","doi-asserted-by":"crossref","first-page":"459","DOI":"10.1007\/s00894-009-0553-7","volume":"16","author":"J Chen","year":"2010","unstructured":"Chen J, Zhang S, Liu X, Zhang Q (2010) J Mol Model 16(3):459","journal-title":"J Mol Model"},{"issue":"8","key":"9693_CR42","doi-asserted-by":"crossref","first-page":"2605","DOI":"10.1021\/jp211768n","volume":"116","author":"P Kar","year":"2012","unstructured":"Kar P, Knecht V (2012) J Phys Chem B 116(8):2605","journal-title":"J Phys Chem B"},{"issue":"6","key":"9693_CR43","doi-asserted-by":"crossref","first-page":"1884","DOI":"10.1021\/jp2074804","volume":"116","author":"BR Meher","year":"2012","unstructured":"Meher BR, Wang Y (2012) J Phys Chem B 116(6):1884","journal-title":"J Phys Chem B"},{"issue":"8","key":"9693_CR44","doi-asserted-by":"crossref","first-page":"1176","DOI":"10.4161\/cc.8.8.8185","volume":"8","author":"A Czarna","year":"2009","unstructured":"Czarna A, Popowicz GM, Pecak A, Wolf S, Dubin G, Holak TA (2009) Cell Cycle 8(8):1176","journal-title":"Cell Cycle"},{"issue":"6","key":"9693_CR45","doi-asserted-by":"crossref","first-page":"1104","DOI":"10.4161\/cc.9.6.10956","volume":"9","author":"GM Popowicz","year":"2010","unstructured":"Popowicz GM, Czarna A, Wolf S (2010) Cell Cycle 9(6):1104","journal-title":"Cell Cycle"},{"key":"9693_CR46","unstructured":"Case DA, Darden TA, Cheatham III TE, Simmerling CL, Wang J, Duke RE, Luo R, Walker RC, Zhang W, Merz KM, Roberts S, Hayik S, Roitberg A, Seabra G, Swails J, G\u00d6tz AW, Kolossv\u00e1ry I, Wong KF, Paesani F, Vanicek J, Wolf RM, Liu J, Wu X, Brozell SR, Steinbrecher T, Gohlke H, Cai Q, Ye X, Wang J, Hsieh M-J, Cui G, Roe DR, Mathews DH, Seetin MG, Salomon-Ferrer R, Sagui C, Babin V, Luchko T, Gusarov S, Kovalenko A, Kollman PA (2012) AMBER 12, University of California, San Francisco"},{"issue":"16","key":"9693_CR47","doi-asserted-by":"crossref","first-page":"1999","DOI":"10.1002\/jcc.10349","volume":"24","author":"Y Duan","year":"2003","unstructured":"Duan Y, Wu C, Chowdhury S, Lee MC, Xiong G, Zhang W, Yang R, Cieplak P, Luo R, Lee T (2003) J Comput Chem 24(16):1999","journal-title":"J Comput Chem"},{"issue":"16","key":"9693_CR48","doi-asserted-by":"crossref","first-page":"1623","DOI":"10.1002\/jcc.10128","volume":"23","author":"A Jakalian","year":"2002","unstructured":"Jakalian A, Jack DB, Bayly CI (2002) J Comput Chem 23(16):1623","journal-title":"J Comput Chem"},{"issue":"2","key":"9693_CR49","doi-asserted-by":"crossref","first-page":"132","DOI":"10.1002\/(SICI)1096-987X(20000130)21:2<132::AID-JCC5>3.0.CO;2-P","volume":"21","author":"A Jakalian","year":"2000","unstructured":"Jakalian A, Bush BL, Jack DB, Bayly CI (2000) J Comput Chem 21(2):132","journal-title":"J Comput Chem"},{"issue":"9","key":"9693_CR50","doi-asserted-by":"crossref","first-page":"1157","DOI":"10.1002\/jcc.20035","volume":"25","author":"J Wang","year":"2004","unstructured":"Wang J, Wolf RM, Caldwell JW, Kollman PA, Case DA (2004) J Comput Chem 25(9):1157","journal-title":"J Comput Chem"},{"issue":"4","key":"9693_CR51","doi-asserted-by":"crossref","first-page":"322","DOI":"10.1007\/BF02367312","volume":"5","author":"TG Coleman","year":"1977","unstructured":"Coleman TG, Mesick HC, Darby RL (1977) Ann Biomed Eng 5(4):322","journal-title":"Ann Biomed Eng"},{"key":"9693_CR52","doi-asserted-by":"crossref","first-page":"10089","DOI":"10.1063\/1.464397","volume":"98","author":"T Darden","year":"1993","unstructured":"Darden T, York D, Pedersen L (1993) J Chem Phys 98:10089","journal-title":"J Chem Phys"},{"issue":"19","key":"9693_CR53","doi-asserted-by":"crossref","first-page":"8577","DOI":"10.1063\/1.470117","volume":"103","author":"U Essmann","year":"1995","unstructured":"Essmann U, Perera L, Berkowitz ML, Darden T, Lee H, Pedersen LG (1995) J Chem Phys 103(19):8577","journal-title":"J Chem Phys"},{"issue":"16","key":"9693_CR54","doi-asserted-by":"crossref","first-page":"1668","DOI":"10.1002\/jcc.20290","volume":"26","author":"DA Case","year":"2005","unstructured":"Case DA, Cheatham TE, Darden T, Gohlke H, Luo R, Merz KM, Onufriev A, Simmerling C, Wang B, Woods RJ (2005) J Comput Chem 26(16):1668","journal-title":"J Comput Chem"},{"issue":"9","key":"9693_CR55","doi-asserted-by":"crossref","first-page":"3314","DOI":"10.1021\/ct300418h","volume":"8","author":"BR Miller III","year":"2012","unstructured":"Miller BR III, McGee TD, Swails JM, Homeyer N, Gohlke H, Roitberg AE (2012) J Chem Theory Comput 8(9):3314","journal-title":"J Chem Theory Comput"},{"issue":"2","key":"9693_CR56","doi-asserted-by":"crossref","first-page":"383","DOI":"10.1002\/prot.20033","volume":"55","author":"A Onufriev","year":"2004","unstructured":"Onufriev A, Bashford D, Case DA (2004) Proteins 55(2):383","journal-title":"Proteins"},{"issue":"4","key":"9693_CR57","doi-asserted-by":"crossref","first-page":"891","DOI":"10.1016\/S0022-2836(03)00610-7","volume":"330","author":"H Gohlke","year":"2003","unstructured":"Gohlke H, Kiel C, Case DA (2003) J Mol Biol 330(4):891","journal-title":"J Mol Biol"},{"issue":"2","key":"9693_CR58","doi-asserted-by":"crossref","first-page":"217","DOI":"10.1002\/(SICI)1096-987X(19990130)20:2<217::AID-JCC4>3.0.CO;2-A","volume":"20","author":"J Weiser","year":"1999","unstructured":"Weiser J, Shenkin PS, Still WC (1999) J Comput Chem 20(2):217","journal-title":"J Comput Chem"},{"issue":"3","key":"9693_CR59","doi-asserted-by":"crossref","first-page":"587","DOI":"10.1016\/j.jmb.2005.05.010","volume":"350","author":"S Uhrinova","year":"2005","unstructured":"Uhrinova S, Uhrin D, Powers H, Watt K, Zheleva D, Fischer P, McInnes C, Barlow PN (2005) J Mol Biol 350(3):587","journal-title":"J Mol Biol"},{"issue":"12","key":"9693_CR60","first-page":"2280","volume":"60","author":"CP Barrett","year":"2004","unstructured":"Barrett CP, Hall BA, Noble MEM (2004) Acta Cryst 60(12):2280","journal-title":"Acta Cryst"},{"issue":"39","key":"9693_CR61","doi-asserted-by":"crossref","first-page":"12692","DOI":"10.1021\/jp104753t","volume":"114","author":"SR Campos","year":"2010","unstructured":"Campos SR, Machuqueiro M, Baptista AM (2010) J Phys Chem B 114(39):12692","journal-title":"J Phys Chem B"},{"issue":"6","key":"9693_CR62","doi-asserted-by":"crossref","first-page":"1167","DOI":"10.4161\/cc.9.6.11067","volume":"9","author":"TL Joseph","year":"2010","unstructured":"Joseph TL, Madhumalar A, Brown CJ, Lane DP, Verma C (2010) Cell Cycle 9(6):1167","journal-title":"Cell Cycle"},{"issue":"10","key":"9693_CR63","doi-asserted-by":"crossref","first-page":"1245","DOI":"10.1007\/s00894-009-0452-y","volume":"15","author":"J Chen","year":"2009","unstructured":"Chen J, Yang M, Hu G, Shi S, Yi C, Zhang Q (2009) J Mol Model 15(10):1245","journal-title":"J Mol Model"},{"issue":"25","key":"9693_CR64","doi-asserted-by":"crossref","first-page":"14330","DOI":"10.1073\/pnas.96.25.14330","volume":"96","author":"LT Chong","year":"1999","unstructured":"Chong LT, Duan Y, Wang L, Massova I, Kollman PA (1999) Proc Natl Acad Sci USA 96(25):14330","journal-title":"Proc Natl Acad Sci USA"},{"issue":"4","key":"9693_CR65","doi-asserted-by":"crossref","first-page":"1058","DOI":"10.1002\/prot.21044","volume":"64","author":"Y Xu","year":"2006","unstructured":"Xu Y, Wang R (2006) Proteins 64(4):1058","journal-title":"Proteins"}],"container-title":["Journal of Computer-Aided Molecular Design"],"original-title":[],"language":"en","link":[{"URL":"http:\/\/link.springer.com\/content\/pdf\/10.1007\/s10822-013-9693-z.pdf","content-type":"application\/pdf","content-version":"vor","intended-application":"text-mining"},{"URL":"http:\/\/link.springer.com\/article\/10.1007\/s10822-013-9693-z\/fulltext.html","content-type":"text\/html","content-version":"vor","intended-application":"text-mining"},{"URL":"http:\/\/link.springer.com\/content\/pdf\/10.1007\/s10822-013-9693-z","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2019,8,3]],"date-time":"2019-08-03T17:54:19Z","timestamp":1564854859000},"score":1,"resource":{"primary":{"URL":"http:\/\/link.springer.com\/10.1007\/s10822-013-9693-z"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2013,11]]},"references-count":65,"journal-issue":{"issue":"11","published-print":{"date-parts":[[2013,11]]}},"alternative-id":["9693"],"URL":"https:\/\/doi.org\/10.1007\/s10822-013-9693-z","relation":{},"ISSN":["0920-654X","1573-4951"],"issn-type":[{"value":"0920-654X","type":"print"},{"value":"1573-4951","type":"electronic"}],"subject":[],"published":{"date-parts":[[2013,11]]}}}