Works matching IS 0920654X AND DT 2011 AND VI 25 AND IP 7

Results: 10

Design of a multi-purpose fragment screening library using molecular complexity and orthogonal diversity metrics.

Published in:

Journal of Computer-Aided Molecular Design, 2011, v. 25, n. 7, p. 621, doi. 10.1007/s10822-011-9434-0

By:

Lau, Wan F.;
Withka, Jane M.;
Hepworth, David;
Magee, Thomas V.;
Du, Yuhua J.;
Bakken, Gregory A.;
Miller, Michael D.;
Hendsch, Zachary S.;
Thanabal, Venkataraman;
Kolodziej, Steve A.;
Li Xing;
Qiyue Hu;
Narasimhan, Lakshmi S.;
Love, Robert;
Charlton, Maura E.;
Hughes, Samantha;
van Hoorn, Willem P.;
Mills, James E.

Publication type:

Article

Assessing the lipophilicity of fragments and early hits.

Published in:

Journal of Computer-Aided Molecular Design, 2011, v. 25, n. 7, p. 663, doi. 10.1007/s10822-011-9435-z

By:

Mortenson, Paul N.;
Murray, Christopher W.

Publication type:

Article

Visualisation of the chemical space of fragments, lead-like and drug-like molecules in PubChem.

Published in:

Journal of Computer-Aided Molecular Design, 2011, v. 25, n. 7, p. 649, doi. 10.1007/s10822-011-9437-x

By:

van Deursen, Ruud;
Blum, Lorenz C.;
Reymond, Jean-Louis

Publication type:

Article

Visualisation and subsets of the chemical universe database GDB-13 for virtual screening.

Published in:

Journal of Computer-Aided Molecular Design, 2011, v. 25, n. 7, p. 637, doi. 10.1007/s10822-011-9436-y

By:

Blum, Lorenz C.;
van Deursen, Ruud;
Reymond, Jean-Louis

Publication type:

Article

Biosensor-based small molecule fragment screening with biolayer interferometry.

Published in:

Journal of Computer-Aided Molecular Design, 2011, v. 25, n. 7, p. 669, doi. 10.1007/s10822-011-9439-8

By:

Wartchow, Charles A.;
Podlaski, Frank;
Li, Shirley;
Rowan, Karen;
Xiaolei Zhang;
Mark, David;
Kuo-Sen Huang

Publication type:

Article

Fragment-based lead discovery: challenges and opportunities.

Published in:

Journal of Computer-Aided Molecular Design, 2011, v. 25, n. 7, p. 607, doi. 10.1007/s10822-011-9451-z

By:

Chaohong Sun;
Petros, Andrew M.;
Hajduk, Philip J.

Publication type:

Article

A comparative study of fragment screening methods on the p38α kinase: new methods, new insights.

Published in:

Journal of Computer-Aided Molecular Design, 2011, v. 25, n. 7, p. 677, doi. 10.1007/s10822-011-9454-9

By:

Pollack, Scott J.;
Beyer, Kim S.;
Lock, Christopher;
Müller, Ilka;
Sheppard, David;
Lipkin, Mike;
Hardick, David;
Blurton, Peter;
Leonard, Philip M.;
Hubbard, Paul A.;
Todd, Daniel;
Richardson, Christine M.;
Ahrens, Thomas;
Baader, Manuel;
Hafenbradl, Doris O.;
Hilyard, Kate;
Bürli, Roland W.

Publication type:

Article

Fragment-based drug discovery: what really works. An interview with Sandy Farmer of Boehringer Ingelheim.

Published in:

2011

By:

Warr, Wendy A.

Publication type:

Interview

Novel isoquinolone PDK1 inhibitors discovered through fragment-based lead discovery.

Published in:

Journal of Computer-Aided Molecular Design, 2011, v. 25, n. 7, p. 689, doi. 10.1007/s10822-011-9456-7

By:

Johnson, M. Catherine;
Qiyue Hu;
Lingardo, Laura;
Ferre, Rose Ann;
Greasley, Samantha;
Jiangli Yan;
Kath, John;
Ping Chen;
Ermolieff, Jacques;
Alton, Gordon

Publication type:

Article

Design of a Fragment Library that maximally represents available chemical space.

Published in:

Journal of Computer-Aided Molecular Design, 2011, v. 25, n. 7, p. 611, doi. 10.1007/s10822-011-9461-x

By:

Schulz, M. N.;
Landström, J.;
Bright, K.;
Hubbard, R. E.

Publication type:

Article