Showing results (121-130 of 277) with videos related to
Sort By:
Pageof 28
Plos One|June 17, 2014
Active-state model of a dopamine D2 receptor-Gαi complex stabilized by aripiprazole-type partial agonistsRalf C Kling, Nuska Tschammer, Harald Lanig, et al.Journal of Chemical Information and Modeling|April 29, 2017
An Efficient Metadynamics-Based Protocol To Model the Binding Affinity and the Transition State Ensemble of G-Protein-Coupled Receptor LigandsNoureldin Saleh, Passainte Ibrahim, Giorgio Saladino, et al.The Journal of Chemical Physics|August 3, 2015
A multi-agent quantum Monte Carlo model for charge transport: Application to organic field-effect transistorsThilo Bauer, Christof M Jäger, Meredith J T Jordan, et al.Journal of Molecular Modeling|February 28, 2014
Self-consistent field convergence for proteins: a comparison of full and localized-molecular-orbital schemesChristian R Wick, Matthias Hennemann, James J P Stewart, et al.Chemistry (Weinheim an Der Bergstrasse, Germany)|June 17, 2008
p-Phenyleneethynylene molecular wires: influence of structure on photoinduced electron-transfer propertiesMateusz Wielopolski, Carmen Atienza, Timothy Clark, et al.Angewandte Chemie (International Ed. in English)|October 5, 2020
Energy Efficient Ultrahigh Flux Separation of Oily Pollutants from Water with Superhydrophilic Nanoscale Metal-Organic Framework ArchitecturesAndre Mähringer, Matthias Hennemann, Timothy Clark, et al.Journal of Chemical Information and Modeling|May 10, 2023
General Metadynamics Protocol To Simulate Activation/Deactivation of Class A GPCRs: Proof of Principle for the Serotonin ReceptorJacqueline C Calderón, Passainte Ibrahim, Dorothea Gobbo, et al.Accounts of Chemical Research|March 19, 2019
Carbon Nanodots for Charge-Transfer ProcessesAlejandro Cadranel, Johannes T Margraf, Volker Strauss, et al.Journal of Medicinal Chemistry|July 26, 2002
Descriptors, physical properties, and drug-likenessMatthias Brüstle, Bernd Beck, Torsten Schindler, et al.Journal of Molecular Modeling|September 5, 2003
AM1* parameters for phosphorus, sulfur and chlorinePaul Winget, Anselm H C Horn, Cenk Selçuki, et al.Pageof 28