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Combinatorial Chemistry & High Throughput Screening
|
January 29, 2002
The linear interaction energy method for predicting ligand binding free energies
J Aqvist, J Marelius
Journal of Computer-Aided Molecular Design
|
May 7, 1998
Ligand binding affinity prediction by linear interaction energy methods
T Hansson, J Marelius, J Aqvist
European Journal of Pharmaceutical Sciences : Official Journal of the European Federation for Pharmaceutical Sciences
|
July 18, 2001
Sensitivity of an empirical affinity scoring function to changes in receptor-ligand complex conformations
J Marelius, K B Ljungberg, J Aqvist
Journal of Molecular Graphics & Modelling
|
October 16, 1999
Q: a molecular dynamics program for free energy calculations and empirical valence bond simulations in biomolecular systems
J Marelius, K Kolmodin, I Feierberg, et al.
Journal of Computer-Aided Molecular Design
|
August 5, 1998
Computation of affinity and selectivity: binding of 2,4-diaminopteridine and 2,4-diaminoquinazoline inhibitors to dihydrofolate reductases
J Marelius, M Graffner-Nordberg, T Hansson, et al.
European Journal of Pharmaceutical Sciences : Official Journal of the European Federation for Pharmaceutical Sciences
|
March 7, 2001
Computational modelling of inhibitor binding to human thrombin
K B Ljungberg, J Marelius, D Musil, et al.
Journal of Medicinal Chemistry
|
October 29, 2000
Computational predictions of binding affinities to dihydrofolate reductase: synthesis and biological evaluation of methotrexate analogues
M Graffner-Nordberg, J Marelius, S Ohlsson, et al.
Page
of 1
Search research articles
Search
Showing results (1-10 of 7) with videos related to
Sort By:
Page
of 1
Combinatorial Chemistry & High Throughput Screening
|
January 29, 2002
The linear interaction energy method for predicting ligand binding free energies
J Aqvist, J Marelius
Journal of Computer-Aided Molecular Design
|
May 7, 1998
Ligand binding affinity prediction by linear interaction energy methods
T Hansson, J Marelius, J Aqvist
European Journal of Pharmaceutical Sciences : Official Journal of the European Federation for Pharmaceutical Sciences
|
July 18, 2001
Sensitivity of an empirical affinity scoring function to changes in receptor-ligand complex conformations
J Marelius, K B Ljungberg, J Aqvist
Journal of Molecular Graphics & Modelling
|
October 16, 1999
Q: a molecular dynamics program for free energy calculations and empirical valence bond simulations in biomolecular systems
J Marelius, K Kolmodin, I Feierberg, et al.
Journal of Computer-Aided Molecular Design
|
August 5, 1998
Computation of affinity and selectivity: binding of 2,4-diaminopteridine and 2,4-diaminoquinazoline inhibitors to dihydrofolate reductases
J Marelius, M Graffner-Nordberg, T Hansson, et al.
European Journal of Pharmaceutical Sciences : Official Journal of the European Federation for Pharmaceutical Sciences
|
March 7, 2001
Computational modelling of inhibitor binding to human thrombin
K B Ljungberg, J Marelius, D Musil, et al.
Journal of Medicinal Chemistry
|
October 29, 2000
Computational predictions of binding affinities to dihydrofolate reductase: synthesis and biological evaluation of methotrexate analogues
M Graffner-Nordberg, J Marelius, S Ohlsson, et al.
Page
of 1