E-LIB Suche - Ergebnisse für: Hawkins, Paul C. D.

1

Unmasking the True Identity of Rapamycin's Minor Conformer:

Crull, Emily B. ; Jain, Ajay N. ; Hawkins, Paul C. D....
Journal of Natural Products. 86 (2023) 7 - p. 1862-1869 , 2023

Link: https://doi.org/10.1021/..

2

Decisions with Confidence: Application to the Conformation ..:

Hawkins, Paul C. D. ; Wlodek, Stanislaw
Journal of Chemical Information and Modeling. 60 (2020) 7 - p. 3518-3533 , 2020

Link: https://doi.org/10.1021/..

3

Conformation Generation: The State of the Art:

Hawkins, Paul C. D.
Journal of Chemical Information and Modeling. 57 (2017) 8 - p. 1747-1756 , 2017

Link: https://doi.org/10.1021/..

4

The Application of Statistical Methods to Cognate Docking: ..:

Hawkins, Paul C. D. ; Kelley, Brian P. ; Warren, Gregory L.
Journal of Chemical Information and Modeling. 54 (2014) 5 - p. 1339-1355 , 2014

Link: https://doi.org/10.1021/..

5

Conformer Generation with OMEGA: Learning from the Data Set..:

Hawkins, Paul C. D. ; Nicholls, Anthony
Journal of Chemical Information and Modeling. 52 (2012) 11 - p. 2919-2936 , 2012

Link: https://doi.org/10.1021/..

6

Conformer Generation with OMEGA: Algorithm and Validation U..:

Hawkins, Paul C. D. ; Skillman, A. Geoffrey ; Warren, Gregory L...
Journal of Chemical Information and Modeling. 50 (2010) 4 - p. 572-584 , 2010

Link: https://doi.org/10.1021/..

7

How to do an evaluation: pitfalls and traps:

Hawkins, Paul C. D. ; Warren, Gregory L. ; Skillman, A. Geoffrey.
Journal of Computer-Aided Molecular Design. 22 (2008) 3-4 - p. 179-190 , 2008

Link: https://doi.org/10.1007/..

8

How to do an evaluation: pitfalls and traps:

Hawkins, Paul C. D. ; Warren, Gregory L. ; Skillman, A. Geoffrey.
Journal of Computer-Aided Molecular Design. 22 (2008) 3-4 - p. 191-192 , 2008

Link: https://doi.org/10.1007/..

9

Comparison of Shape-Matching and Docking as Virtual Screeni..:

Hawkins, Paul C. D. ; Skillman, A. Geoffrey ; Nicholls, Anthony
Journal of Medicinal Chemistry. 50 (2006) 1 - p. 74-82 , 2006

Link: https://doi.org/10.1021/..

10

Synthesis of peptide analogues containing phosphonamidate m..:

Camp, Nicholas P. ; Perrey, David A. ; Kinchington, Derek..
Bioorganic & Medicinal Chemistry. 3 (1995) 3 - p. 297-312 , 1995

Link: https://doi.org/10.1016/..

11

Synthesis of stereochemically defined phosphonamidate-conta..:

Camp, Nicholas P. ; Hawkins, Paul C.D. ; Hitchcock, Peter B..
Bioorganic & Medicinal Chemistry Letters. 2 (1992) 9 - p. 1047-1052 , 1992

Link: https://doi.org/10.1016/..

12

Unmasking the True Identity of Rapamycin's Minor Conformer:

Crull, Emily B ; Jain, Ajay N ; Hawkins, Paul C. D...
http://www.ncbi.nlm.nih.gov/pmc/articles/PMC10391620/. , 2023

Link: http://www.ncbi.nlm.nih...

13

Conformational Sampling of Macrocyclic Drugs in Different E..:

Poongavanam, Vasanthanathan ; Danelius, Emma ; Peintner, Stefan...
info:eu-repo/semantics/altIdentifier/pmid/30320271. , 2018

Link: http://hdl.handle.net/23..

14

Conformational Sampling of Macrocyclic Drugs in Different E..:

Poongavanam, Vasanthanathan ; Danelius, Emma ; Peintner, Stefan...
ACS Omega, 2018, 3:9, s. 11742-11757. , 2018

Link: http://urn.kb.se/resolve..

15

Conformational Sampling of Macrocyclic Drugs in Different E..:

Poongavanam, Vasanthanathan ; Danelius, Emma ; Peintner, Stefan...
http://www.ncbi.nlm.nih.gov/pmc/articles/PMC6173504/. , 2018

Link: http://www.ncbi.nlm.nih...