Format
Sort by
Items per page

Send to

Choose Destination

Links from Books

Items: 1 to 20 of 41

1.

Optimization by simulated annealing.

Kirkpatrick S, Gelatt CD Jr, Vecchi MP.

Science. 1983 May 13;220(4598):671-80.

PMID:
17813860
2.
3.

Experimental and computational approaches to estimate solubility and permeability in drug discovery and development settings.

Lipinski CA, Lombardo F, Dominy BW, Feeney PJ.

Adv Drug Deliv Rev. 2001 Mar 1;46(1-3):3-26. Review.

PMID:
11259830
4.

Designing targeted libraries with genetic algorithms.

Sheridan RP, SanFeliciano SG, Kearsley SK.

J Mol Graph Model. 2000 Aug-Oct;18(4-5):320-34, 525.

PMID:
11143552
5.

Bacteriorhodopsin: the functional details of a molecular machine are being resolved

Heberle J, Fitter J, Sass HJ, Buldt G.

Biophys Chem. 2000 Jul 15;85(2-3):229-48.

PMID:
10961509
6.

How good are support vector machines?

Raudys S.

Neural Netw. 2000 Jan;13(1):17-9. Review.

PMID:
10935455
7.

De novo design of molecular architectures by evolutionary assembly of drug-derived building blocks.

Schneider G, Lee ML, Stahl M, Schneider P.

J Comput Aided Mol Des. 2000 Jul;14(5):487-94.

PMID:
10896320
9.

Basic concepts of artificial neural network (ANN) modeling and its application in pharmaceutical research.

Agatonovic-Kustrin S, Beresford R.

J Pharm Biomed Anal. 2000 Jun;22(5):717-27. Review.

PMID:
10815714
10.

High-throughput screening.

Grepin C, Pernelle C.

Drug Discov Today. 2000 May;5(5):212-214. No abstract available.

PMID:
10790267
11.

Dynamic diversity in drug discovery: Putting small-molecule evolution to work.

Karan I I, Miller BL.

Drug Discov Today. 2000 Feb;5(2):67-75.

PMID:
10652457
12.

Computational methods for the prediction of 'drug-likeness'

Clark DE, Pickett SD.

Drug Discov Today. 2000 Feb;5(2):49-58.

PMID:
10652455
13.

Recognizing molecules with drug-like properties.

Walters WP, Ajay, Murcko MA.

Curr Opin Chem Biol. 1999 Aug;3(4):384-7. Review.

PMID:
10419858
14.

Adapting operator settings in genetic algorithms.

Tuson A, Ross P.

Evol Comput. 1998 Summer;6(2):161-84.

PMID:
10021745
15.

Structures of membrane proteins determined at atomic resolution.

Sakai H, Tsukihara T.

J Biochem. 1998 Dec 1;124(6):1051-9. Review.

16.

Artificial neural networks for computer-based molecular design.

Schneider G, Wrede P.

Prog Biophys Mol Biol. 1998;70(3):175-222. Review.

PMID:
9830312
17.

Flexible docking using Tabu search and an empirical estimate of binding affinity.

Baxter CA, Murray CW, Clark DE, Westhead DR, Eldridge MD.

Proteins. 1998 Nov 15;33(3):367-82.

PMID:
9829696
18.

Computer search algorithms in protein modification and design.

Desjarlais JR, Clarke ND.

Curr Opin Struct Biol. 1998 Aug;8(4):471-5. Review.

PMID:
9729739
19.

Computational methods in molecular diversity and combinatorial chemistry.

Bures MG, Martin YC.

Curr Opin Chem Biol. 1998 Jun;2(3):376-80. Review.

PMID:
9691077

Supplemental Content

Support Center