- Wang R, Gao Y, Lai L (2000) LigBuilder: a
 multi-purpose program for structure-based
 drug design. Mol Model Annu 6
 (7–8):498–516
- de Kloe GE, Bailey D, Leurs R, de Esch IJ
 (2009) Transforming fragments into candi-
 dates: small becomes big in medicinal chemis-
 try. Drug Discov Today 14(13):630–646
- Rees DC, Congreve M, Murray CW, Carr R
 (2004) Fragment-based lead discovery. Nat
 Rev Drug Discov 3(8):660–672
- Kumar A, Voet A, Zhang K (2012) Fragment
 based drug design: from experimental to
 computational approaches. Curr Med Chem
 19(30):5128–5147
- Schro ̈dinger L (2013) Small-molecule drug
 discovery suite 2013–3: QikProp, version 3.8.
 Schro ̈dinger, LLC, New York
- Schro ̈dinger Release (2014) 1: Desmond
 molecular dynamics system, version 3.7. DE
 Shaw Research, New York, NY, Maestro-
 Desmond Interoperability Tools, version 3
- Schro ̈dinger Release (2013) 1: Schro ̈dinger
 Suite 2013 Protein Preparation Wizard. Epik
 version 2:2013
 63. Schro ̈dinger L (2013) Small-molecule drug
 discovery suite 2013–3: Glide, version 6.1.
 Schro ̈dinger, LLC, New York
 64. Pargellis C, Tong L, Churchill L, Cirillo PF,
 Gilmore T, Graham AG, Grob PM, Hickey ER,
 Moss N, Pav S (2002) Inhibition of p38 MAP
 kinase by utilizing a novel allosteric binding
 site. Nat Struct Mol Biol 9(4):268–272
 65. Guarnieri F (2015) Designing a small molecule
 erythropoietin mimetic. Methods Mol Biol
 1289:185–210
 66. Cohen SB, Cheng TT, Chindalore V,
 Damjanov N, Burgos-Vargas R, DeLora P,
 Zimany K, Travers H, Caulfield JP (2009)
 Evaluation of the efficacy and safety of pamapi-
 mod, a p38 MAP kinase inhibitor, in a double-
 blind, methotrexate-controlled study of
 patients with active rheumatoid arthritis.
 Arthritis Rheumatol 60(2):335–344
 67. Kandil S, Biondaro S, Vlachakis D, Cummins
 A-C, Coluccia A, Berry C, Leyssen P, Neyts J,
 Brancale A (2009) Discovery of a novel HCV
 helicase inhibitor by a de novo drug design
 approach. Bioorg Med Chem Lett 19
 (11):2935–2937
144 Shashank P. Katiyar et al.
