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

Casper Steinmann

Showing results (11-20 of 31) with videos related to

Pageof 4
Sort By:
The Journal of Physical Chemistry. A|June 24, 2015
Correction to "Polarizable Density Embedding: A New QM/QM/MM-based Computational Strategy"Jógvan Magnus Haugaard Olsen, Casper Steinmann, Kenneth Ruud, et al.
The Journal of Physical Chemistry. A|January 17, 2015
Polarizable density embedding: a new QM/QM/MM-based computational strategyJógvan Magnus Haugaard Olsen, Casper Steinmann, Kenneth Ruud, et al.
Journal of Chemical Theory and Computation|January 3, 2017
Computational Approach to Evaluation of Optical Properties of Membrane ProbesLina J Nåbo, Nanna Holmgaard List, Casper Steinmann, et al.
Plos One|October 3, 2012
FragIt: a tool to prepare input files for fragment based quantum chemical calculationsCasper Steinmann, Mikael W Ibsen, Anne S Hansen, et al.
Plos One|February 22, 2014
Hybrid RHF/MP2 geometry optimizations with the effective fragment molecular orbital methodAnders S Christensen, Casper Steinmann, Dmitri G Fedorov, et al.
Journal of Chemical Theory and Computation|December 20, 2019
Cost-Effective Potential for Accurate Polarizable Embedding Calculations in Protein EnvironmentsPeter Reinholdt, Erik Rosendahl Kjellgren, Casper Steinmann, et al.
Peerj|August 2, 2013
A computational method for the systematic screening of reaction barriers in enzymes: searching for Bacillus circulans xylanase mutants with greater activity towards a synthetic substrateMartin R Hediger, Casper Steinmann, Luca De Vico, et al.
Plos One|July 12, 2013
Interface of the polarizable continuum model of solvation with semi-empirical methods in the GAMESS programCasper Steinmann, Kristoffer L Blædel, Anders S Christensen, et al.
Journal of Chemical Theory and Computation|November 20, 2015
Fully Integrated Effective Fragment Molecular Orbital MethodSpencer R Pruitt, Casper Steinmann, Jan H Jensen, et al.
Journal of Chemical Theory and Computation|August 22, 2017
Modeling Electronic Circular Dichroism within the Polarizable Embedding ApproachMorten S Nørby, Jógvan Magnus Haugaard Olsen, Casper Steinmann, et al.
Pageof 4

Showing results (11-20 of 31) with videos related to

Sort By:
Pageof 4
The Journal of Physical Chemistry. A|June 24, 2015
Correction to "Polarizable Density Embedding: A New QM/QM/MM-based Computational Strategy"Jógvan Magnus Haugaard Olsen, Casper Steinmann, Kenneth Ruud, et al.
The Journal of Physical Chemistry. A|January 17, 2015
Polarizable density embedding: a new QM/QM/MM-based computational strategyJógvan Magnus Haugaard Olsen, Casper Steinmann, Kenneth Ruud, et al.
Journal of Chemical Theory and Computation|January 3, 2017
Computational Approach to Evaluation of Optical Properties of Membrane ProbesLina J Nåbo, Nanna Holmgaard List, Casper Steinmann, et al.
Plos One|October 3, 2012
FragIt: a tool to prepare input files for fragment based quantum chemical calculationsCasper Steinmann, Mikael W Ibsen, Anne S Hansen, et al.
Plos One|February 22, 2014
Hybrid RHF/MP2 geometry optimizations with the effective fragment molecular orbital methodAnders S Christensen, Casper Steinmann, Dmitri G Fedorov, et al.
Journal of Chemical Theory and Computation|December 20, 2019
Cost-Effective Potential for Accurate Polarizable Embedding Calculations in Protein EnvironmentsPeter Reinholdt, Erik Rosendahl Kjellgren, Casper Steinmann, et al.
Peerj|August 2, 2013
A computational method for the systematic screening of reaction barriers in enzymes: searching for Bacillus circulans xylanase mutants with greater activity towards a synthetic substrateMartin R Hediger, Casper Steinmann, Luca De Vico, et al.
Plos One|July 12, 2013
Interface of the polarizable continuum model of solvation with semi-empirical methods in the GAMESS programCasper Steinmann, Kristoffer L Blædel, Anders S Christensen, et al.
Journal of Chemical Theory and Computation|November 20, 2015
Fully Integrated Effective Fragment Molecular Orbital MethodSpencer R Pruitt, Casper Steinmann, Jan H Jensen, et al.
Journal of Chemical Theory and Computation|August 22, 2017
Modeling Electronic Circular Dichroism within the Polarizable Embedding ApproachMorten S Nørby, Jógvan Magnus Haugaard Olsen, Casper Steinmann, et al.
Pageof 4