scholarly article | Q13442814 |
P356 | DOI | 10.1002/CMDC.201800093 |
P698 | PubMed publication ID | 29726604 |
P50 | author | Martin Smieško | Q59688694 |
P2093 | author name string | Joel Wahl | |
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P4510 | describes a project that uses | molecular dynamics simulation | Q901663 |
P433 | issue | 13 | |
P304 | page(s) | 1325-1335 | |
P577 | publication date | 2018-05-30 | |
P1433 | published in | ChemMedChem | Q2962252 |
P1476 | title | Thermodynamic Insight into the Effects of Water Displacement and Rearrangement upon Ligand Modifications using Molecular Dynamics Simulations | |
P478 | volume | 13 |
Q92702841 | Allosteric Binding Sites On Nuclear Receptors: Focus On Drug Efficacy and Selectivity |
Q91034551 | Assessing the Predictive Power of Relative Binding Free Energy Calculations for Test Cases Involving Displacement of Binding Site Water Molecules |
Q91235937 | Spontaneous Ligand Access Events to Membrane-Bound Cytochrome P450 2D6 Sampled at Atomic Resolution |
Q92917819 | Water in protein hydration and ligand recognition |
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