论文信息 - Peptides to non-peptides: leads from structureless virtual screening - 字舞流文

Peptides to non-peptides: leads from structureless virtual screening

Andy Vinter | Mark D. Mackey | Tim Cheeseright

[1] A. Davis,et al. Strategic approaches to drug design. II. Modelling studies on phosphodiesterase substrates and inhibitors , 1987, J. Comput. Aided Mol. Des..

[2] Jeremy G. Vinter,et al. Extended electron distributions applied to the molecular mechanics of some intermolecular interactions. II. Organic complexes , 1996, J. Comput. Aided Mol. Des..

[3] Jeremy G. Vinter,et al. Complementary polytopic interactions (CPI) as revealed by molecular modelling using the XED force field , 2001 .

[4] E. Westhof,et al. Host-guest molecular interactions: from chemistry to biology , 1991 .

[5] Gianni Chessari,et al. An evaluation of force-field treatments of aromatic interactions. , 2002, Chemistry.

[6] Jeremy G. Vinter,et al. The matching of electrostatic extrema: A useful method in drug design? A study of phosphodiesterase III inhibitors , 1995, J. Comput. Aided Mol. Des..

[7] Jeremy G. Vinter,et al. Extended electron distributions applied to the molecular mechanics of some intermolecular interactions , 1994, J. Comput. Aided Mol. Des..

[8] J. G. Vinter,et al. Substituent effects on cation–π interactions: A quantitative study , 2002, Proceedings of the National Academy of Sciences of the United States of America.

[9] Jeremy G. Vinter,et al. Multiconformational composite molecular potential fields in the analysis of drug action. I. Methodology and first evaluation using 5-HT and histamine action as examples , 1995, J. Comput. Aided Mol. Des..