Jove
Visualize
Contact Us
JoVE
x logofacebook logolinkedin logoyoutube logo
ABOUT JoVE
OverviewLeadershipBlogJoVE Help Center
AUTHORS
Publishing ProcessEditorial BoardScope & PoliciesPeer ReviewFAQSubmit
LIBRARIANS
TestimonialsSubscriptionsAccessResourcesLibrary Advisory BoardFAQ
RESEARCH
JoVE JournalMethods CollectionsJoVE Encyclopedia of ExperimentsArchive
EDUCATION
JoVE CoreJoVE BusinessJoVE Science EducationJoVE Lab ManualFaculty Resource CenterFaculty Site
Terms & Conditions of Use
Privacy Policy
Policies

Filters

Julia E Rice

Showing results (1-10 of 35) with videos related to

Pageof 4
Sort By:
Journal of Computer-Aided Molecular Design|August 21, 2003
Fast 3D molecular superposition and similarity search in databases of flexible moleculesAndreas Krämer, Hans W Horn, Julia E Rice
The Journal of Physical Chemistry. B|June 15, 2010
Accounting for polarization cost when using fixed charge force fields. II. Method and application for computing effect of polarization cost on free energy of hydrationWilliam C Swope, Hans W Horn, Julia E Rice
The Journal of Physical Chemistry Letters|August 12, 2015
Dominant Decomposition Pathways for Ethereal Solvents in Li-O2 BatteriesJeannette M García, Hans W Horn, Julia E Rice
The Journal of Physical Chemistry. B|June 15, 2010
Accounting for polarization cost when using fixed charge force fields. I. Method for computing energyWilliam C Swope, Hans W Horn, Julia E Rice
The Journal of Physical Chemistry. A|April 11, 2023
Challenges in the Use of Quantum Computing Hardware-Efficient Ansätze in Electronic Structure TheoryRuhee D'Cunha, T Daniel Crawford, Mario Motta, et al.
The Journal of Physical Chemistry. A|January 13, 2023
<i>N</i>-Electron Valence Perturbation Theory with Reference Wave Functions from Quantum Computing: Application to the Relative Stability of Hydroxide Anion and Hydroxyl RadicalAlessandro Tammaro, Davide E Galli, Julia E Rice, et al.
Journal of Chemical Theory and Computation|October 21, 2014
ff14ipq: A Self-Consistent Force Field for Condensed-Phase Simulations of ProteinsDavid S Cerutti, William C Swope, Julia E Rice, et al.
The Journal of Physical Chemistry. B|February 6, 2013
Derivation of fixed partial charges for amino acids accommodating a specific water model and implicit polarizationDavid S Cerutti, Julia E Rice, William C Swope, et al.
Chemical Communications (Cambridge, England)|January 25, 2011
Catalytic insights into acid/base conjugates: highly selective bifunctional catalysts for the ring-opening polymerization of lactideDaniel J Coady, Kazuki Fukushima, Hans W Horn, et al.
Journal of Computer-Aided Molecular Design|December 27, 2011
Alchemical prediction of hydration free energies for SAMPLDavid L Mobley, Shaui Liu, David S Cerutti, et al.
Pageof 4

Showing results (1-10 of 35) with videos related to

Sort By:
Pageof 4
Journal of Computer-Aided Molecular Design|August 21, 2003
Fast 3D molecular superposition and similarity search in databases of flexible moleculesAndreas Krämer, Hans W Horn, Julia E Rice
The Journal of Physical Chemistry. B|June 15, 2010
Accounting for polarization cost when using fixed charge force fields. II. Method and application for computing effect of polarization cost on free energy of hydrationWilliam C Swope, Hans W Horn, Julia E Rice
The Journal of Physical Chemistry Letters|August 12, 2015
Dominant Decomposition Pathways for Ethereal Solvents in Li-O2 BatteriesJeannette M García, Hans W Horn, Julia E Rice
The Journal of Physical Chemistry. B|June 15, 2010
Accounting for polarization cost when using fixed charge force fields. I. Method for computing energyWilliam C Swope, Hans W Horn, Julia E Rice
The Journal of Physical Chemistry. A|April 11, 2023
Challenges in the Use of Quantum Computing Hardware-Efficient Ansätze in Electronic Structure TheoryRuhee D'Cunha, T Daniel Crawford, Mario Motta, et al.
The Journal of Physical Chemistry. A|January 13, 2023
<i>N</i>-Electron Valence Perturbation Theory with Reference Wave Functions from Quantum Computing: Application to the Relative Stability of Hydroxide Anion and Hydroxyl RadicalAlessandro Tammaro, Davide E Galli, Julia E Rice, et al.
Journal of Chemical Theory and Computation|October 21, 2014
ff14ipq: A Self-Consistent Force Field for Condensed-Phase Simulations of ProteinsDavid S Cerutti, William C Swope, Julia E Rice, et al.
The Journal of Physical Chemistry. B|February 6, 2013
Derivation of fixed partial charges for amino acids accommodating a specific water model and implicit polarizationDavid S Cerutti, Julia E Rice, William C Swope, et al.
Chemical Communications (Cambridge, England)|January 25, 2011
Catalytic insights into acid/base conjugates: highly selective bifunctional catalysts for the ring-opening polymerization of lactideDaniel J Coady, Kazuki Fukushima, Hans W Horn, et al.
Journal of Computer-Aided Molecular Design|December 27, 2011
Alchemical prediction of hydration free energies for SAMPLDavid L Mobley, Shaui Liu, David S Cerutti, et al.
Pageof 4