Beck B - Search Results

1

A temperature-dependent quantum mechanical/neural net model for vapor pressure.

Chalk AJ, Beck B, Clark T. Chalk AJ, et al. Among authors: beck b. J Chem Inf Comput Sci. 2001 Jul-Aug;41(4):1053-9. doi: 10.1021/ci0103222. J Chem Inf Comput Sci. 2001. PMID: 11500124

2

QM/NN QSPR models with error estimation: vapor pressure and logP.

Beck B, Breindl A, Clark T. Beck B, et al. J Chem Inf Comput Sci. 2000 Jul;40(4):1046-51. doi: 10.1021/ci990131n. J Chem Inf Comput Sci. 2000. PMID: 10955536

3

A quantum mechanical/neural net model for boiling points with error estimation.

Chalk AJ, Beck B, Clark T. Chalk AJ, et al. Among authors: beck b. J Chem Inf Comput Sci. 2001 Mar-Apr;41(2):457-62. doi: 10.1021/ci0004614. J Chem Inf Comput Sci. 2001. PMID: 11277737

4

Sharpening the toolbox of computational chemistry: a new approximation of critical f-values for multiple linear regression.

Kramer C, Tautermann CS, Livingstone DJ, Salt DW, Whitley DC, Beck B, Clark T. Kramer C, et al. Among authors: beck b. J Chem Inf Model. 2009 Jan;49(1):28-34. doi: 10.1021/ci800318q. J Chem Inf Model. 2009. PMID: 19105731

5

A surface-integral model for log P OW.

Kramer C, Beck B, Clark T. Kramer C, et al. Among authors: beck b. J Chem Inf Model. 2010 Mar 22;50(3):429-36. doi: 10.1021/ci900431f. J Chem Inf Model. 2010. PMID: 20108914

6

The inhibition of alpha-chymotrypsin predicted using theoretically derived molecular properties.

Beck B, Glen RC, Clark T. Beck B, et al. J Mol Graph. 1996 Jun;14(3):130-5, 142. doi: 10.1016/s0263-7855(96)00041-0. J Mol Graph. 1996. PMID: 8901640

7

Descriptors, physical properties, and drug-likeness.

Brüstle M, Beck B, Schindler T, King W, Mitchell T, Clark T. Brüstle M, et al. Among authors: beck b. J Med Chem. 2002 Aug 1;45(16):3345-55. doi: 10.1021/jm011027b. J Med Chem. 2002. PMID: 12139446

8

A consistent dataset of kinetic solubilities for early-phase drug discovery.

Kramer C, Heinisch T, Fligge T, Beck B, Clark T. Kramer C, et al. Among authors: beck b. ChemMedChem. 2009 Sep;4(9):1529-36. doi: 10.1002/cmdc.200900205. ChemMedChem. 2009. PMID: 19588473

9

Insolubility classification with accurate prediction probabilities using a MetaClassifier.

Kramer C, Beck B, Clark T. Kramer C, et al. Among authors: beck b. J Chem Inf Model. 2010 Mar 22;50(3):404-14. doi: 10.1021/ci900377e. J Chem Inf Model. 2010. PMID: 20088498

10

A composite model for HERG blockade.

Kramer C, Beck B, Kriegl JM, Clark T. Kramer C, et al. Among authors: beck b. ChemMedChem. 2008 Feb;3(2):254-65. doi: 10.1002/cmdc.200700221. ChemMedChem. 2008. PMID: 18061919

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