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Journal of Chemical Information and Modeling
|
June 1, 2005
Small molecule shape-fingerprints
James A Haigh, Barry T Pickup, J Andrew Grant, et al.
Journal of Computer-Aided Molecular Design
|
February 5, 2018
Leaving us with fond memories, smiles, SMILES and, alas, tears: a tribute to David Weininger, 1952-2016
Johann Gasteiger, Yvonne Martin, Anthony Nicholls, et al.
Journal of Computer-Aided Molecular Design
|
January 25, 2008
How to do an evaluation: pitfalls and traps
Paul C D Hawkins, Gregory L Warren, A Geoffrey Skillman, et al.
Journal of Computational Chemistry
|
March 27, 2002
Rapid grid-based construction of the molecular surface and the use of induced surface charge to calculate reaction field energies: applications to the molecular systems and geometric objects
Walter Rocchia, Sundaram Sridharan, Anthony Nicholls, et al.
Journal of Chemical Information and Modeling
|
November 5, 2019
Virtual Screening in the Cloud: How Big Is Big Enough?
Christoph Grebner, Erik Malmerberg, Andrew Shewmaker, et al.
Sports Medicine - Open
|
June 6, 2019
The Effect of a Resistance Training Session on Physiological and Thermoregulatory Measures of Sub-maximal Running Performance in the Heat in Heat-Acclimatized Men
Kenji Doma, Anthony Nicholls, Daniel Gahreman, et al.
Journal of Chemical Theory and Computation
|
May 7, 2013
Accurate Molecular Polarizabilities Based on Continuum Electrostatics
Jean-François Truchon, Anthony Nicholls, Radu I Iftimie, et al.
Journal of Chemical Theory and Computation
|
May 15, 2014
Integrated Continuum Dielectric Approaches to treat Molecular Polarizability and the Condensed Phase: Refractive Index and Implicit Solvation
Jean-François Truchon, Anthony Nicholls, Benoît Roux, et al.
American Journal of Kidney Diseases : the Official Journal of the National Kidney Foundation
|
April 25, 2006
Sirolimus-induced remission of posttransplantation lymphoproliferative disorder
Brett Cullis, Richard D'Souza, Paul McCullagh, et al.
Journal of Computer-Aided Molecular Design
|
May 11, 2010
The SAMPL2 blind prediction challenge: introduction and overview
Matthew T Geballe, A Geoffrey Skillman, Anthony Nicholls, et al.
Page
of 4
Search research articles
Search
Showing results (21-30 of 40) with videos related to
Sort By:
Page
of 4
Journal of Chemical Information and Modeling
|
June 1, 2005
Small molecule shape-fingerprints
James A Haigh, Barry T Pickup, J Andrew Grant, et al.
Journal of Computer-Aided Molecular Design
|
February 5, 2018
Leaving us with fond memories, smiles, SMILES and, alas, tears: a tribute to David Weininger, 1952-2016
Johann Gasteiger, Yvonne Martin, Anthony Nicholls, et al.
Journal of Computer-Aided Molecular Design
|
January 25, 2008
How to do an evaluation: pitfalls and traps
Paul C D Hawkins, Gregory L Warren, A Geoffrey Skillman, et al.
Journal of Computational Chemistry
|
March 27, 2002
Rapid grid-based construction of the molecular surface and the use of induced surface charge to calculate reaction field energies: applications to the molecular systems and geometric objects
Walter Rocchia, Sundaram Sridharan, Anthony Nicholls, et al.
Journal of Chemical Information and Modeling
|
November 5, 2019
Virtual Screening in the Cloud: How Big Is Big Enough?
Christoph Grebner, Erik Malmerberg, Andrew Shewmaker, et al.
Sports Medicine - Open
|
June 6, 2019
The Effect of a Resistance Training Session on Physiological and Thermoregulatory Measures of Sub-maximal Running Performance in the Heat in Heat-Acclimatized Men
Kenji Doma, Anthony Nicholls, Daniel Gahreman, et al.
Journal of Chemical Theory and Computation
|
May 7, 2013
Accurate Molecular Polarizabilities Based on Continuum Electrostatics
Jean-François Truchon, Anthony Nicholls, Radu I Iftimie, et al.
Journal of Chemical Theory and Computation
|
May 15, 2014
Integrated Continuum Dielectric Approaches to treat Molecular Polarizability and the Condensed Phase: Refractive Index and Implicit Solvation
Jean-François Truchon, Anthony Nicholls, Benoît Roux, et al.
American Journal of Kidney Diseases : the Official Journal of the National Kidney Foundation
|
April 25, 2006
Sirolimus-induced remission of posttransplantation lymphoproliferative disorder
Brett Cullis, Richard D'Souza, Paul McCullagh, et al.
Journal of Computer-Aided Molecular Design
|
May 11, 2010
The SAMPL2 blind prediction challenge: introduction and overview
Matthew T Geballe, A Geoffrey Skillman, Anthony Nicholls, et al.
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of 4