[1] Acad Athens, Biomed Res Fdn, Athens 11527, Greece
[2] Univ Calif Davis, Dept Chem, Davis, CA 95616 USA
[3] RMIT Univ, Sch Appl Sci & Hlth Innovat Res Inst, Melbourne, Vic 3001, Australia
[4] Univ Calif Irvine, Dept Chem, Irvine, CA 92697 USA
[5] Univ Nice Sophia Antipolis, Inst Pharmacol Mol & Cellulaire, F-06560 Nice, France
[6] Ctr Natl Rech Sci, UMR 7275, F-06560 Nice, France
[7] Zuse Inst Berlin, Dept Visual Data Anal, D-14195 Berlin, Germany
[8] Rutgers State Univ, Dept Phys, Ctr Computat & Integrat Biol, Camden, NJ USA
[9] Univ Coll Dublin, Sch Phys, Dublin 4, Ireland
[10] Univ Coll Dublin, Complex & Adapt Syst Lab, Dublin 4, Ireland
[11] Temple Univ, Inst Computat & Mol Sci, Philadelphia, PA 19122 USA
[12] Univ Granada, Dept Artificial Intelligence, E-18071 Granada, Spain
[13] Linnaeus Univ, Dept Chem & Biomed Sci, S-39182 Kalmar, Sweden
[14] Linnaeus Univ, Ctr Biomat Chem, S-39182 Kalmar, Sweden
[15] IBPC, Lab Biochim Theor, Paris, France
[16] CNRS, Paris, France
[17] Univ Lorraine, SRSMC, UMR 7565, F-54500 Vandoeuvre Les Nancy, France
[18] Lomonosov Moscow State Univ, Moscow 119991, Russia
[19] Univ Athens, Dept Pharmaceut Chem, Fac Pharm, Athens 15771, Greece
[20] Univ Southampton, Dept Chem, Southampton SO17 1BJ, Hants, England
[21] Univ Alberta, Dept Biochem, Fac Med & Dent, Membrane Prot Dis Res Grp, Edmonton, AB T6G 2H7, Canada
[22] Univ Pompeu Fabra, IMIM Hosp Mar Med Res Inst, Dept Expt & Hlth Sci, Res Programme Biomed Informat GRIB, Barcelona 08003, Spain
[23] CNRS, SRSMC, UMR 7565, F-54500 Vandoeuvre Les Nancy, France
[24] Johns Hopkins Univ, Howard Hughes Med Inst, Dept Mol Biol & Genet, Sch Med, Baltimore, MD 21205 USA
[25] Univ Cambridge, Univ Chem Labs, Cambridge CB2 1EW, England
[26] Oak Ridge Natl Lab, Oak Ridge, TN 37831 USA
[27] Free Univ Berlin, Dept Phys, Theoret Mol Biophys, D-14195 Berlin, Germany