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Anthony Nicholls

Showing results (31-40 of 40) with videos related to

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Biopolymers|February 13, 2003
Gaussian docking functionsMark R McGann, Harold R Almond, Anthony Nicholls, et al.
Journal of Chemical Information and Modeling|September 26, 2006
Lingos, finite state machines, and fast similarity searchingJ Andrew Grant, James A Haigh, Barry T Pickup, et al.
Drug Discovery Today|June 26, 2012
Essential considerations for using protein-ligand structures in drug discoveryGregory L Warren, Thanh D Do, Brian P Kelley, et al.
Journal of Computer-Aided Molecular Design|March 18, 2014
Efficient calculation of SAMPL4 hydration free energies using OMEGA, SZYBKI, QUACPAC, and Zap TKBenjamin A Ellingson, Matthew T Geballe, Stanislaw Wlodek, et al.
PLOS Global Public Health|March 12, 2025
We are not doing enough: Truth-telling and Aboriginal and Torres Strait Islander history in Australian Public HealthJasper Garay, Michelle Dickson, Candace Angelo, et al.
Journal of Medicinal Chemistry|January 25, 2008
Predicting small-molecule solvation free energies: an informal blind test for computational chemistryAnthony Nicholls, David L Mobley, J Peter Guthrie, et al.
Journal of Medicinal Chemistry|February 18, 2010
Molecular shape and medicinal chemistry: a perspectiveAnthony Nicholls, Georgia B McGaughey, Robert P Sheridan, et al.
Journal of Medical Genetics|September 28, 2014
Factors determining penetrance in familial atypical haemolytic uraemic syndromeFrancis H Sansbury, Heather J Cordell, Coralie Bingham, et al.
Journal of Chemical Information and Modeling|October 17, 2024
Exploration of Cryptic Pockets Using Enhanced Sampling Along Normal Modes: A Case Study of KRAS <sup>G12D</sup>Neha Vithani, She Zhang, Jeffrey P Thompson, et al.
Structure (London, England : 1993)|April 7, 2016
Outcome of the First wwPDB/CCDC/D3R Ligand Validation WorkshopPaul D Adams, Kathleen Aertgeerts, Cary Bauer, et al.
Pageof 4

Showing results (31-40 of 40) with videos related to

Sort By:
Pageof 4
You have reached the last page of results.This site can display upto 40 results.
Biopolymers|February 13, 2003
Gaussian docking functionsMark R McGann, Harold R Almond, Anthony Nicholls, et al.
Journal of Chemical Information and Modeling|September 26, 2006
Lingos, finite state machines, and fast similarity searchingJ Andrew Grant, James A Haigh, Barry T Pickup, et al.
Drug Discovery Today|June 26, 2012
Essential considerations for using protein-ligand structures in drug discoveryGregory L Warren, Thanh D Do, Brian P Kelley, et al.
Journal of Computer-Aided Molecular Design|March 18, 2014
Efficient calculation of SAMPL4 hydration free energies using OMEGA, SZYBKI, QUACPAC, and Zap TKBenjamin A Ellingson, Matthew T Geballe, Stanislaw Wlodek, et al.
PLOS Global Public Health|March 12, 2025
We are not doing enough: Truth-telling and Aboriginal and Torres Strait Islander history in Australian Public HealthJasper Garay, Michelle Dickson, Candace Angelo, et al.
Journal of Medicinal Chemistry|January 25, 2008
Predicting small-molecule solvation free energies: an informal blind test for computational chemistryAnthony Nicholls, David L Mobley, J Peter Guthrie, et al.
Journal of Medicinal Chemistry|February 18, 2010
Molecular shape and medicinal chemistry: a perspectiveAnthony Nicholls, Georgia B McGaughey, Robert P Sheridan, et al.
Journal of Medical Genetics|September 28, 2014
Factors determining penetrance in familial atypical haemolytic uraemic syndromeFrancis H Sansbury, Heather J Cordell, Coralie Bingham, et al.
Journal of Chemical Information and Modeling|October 17, 2024
Exploration of Cryptic Pockets Using Enhanced Sampling Along Normal Modes: A Case Study of KRAS <sup>G12D</sup>Neha Vithani, She Zhang, Jeffrey P Thompson, et al.
Structure (London, England : 1993)|April 7, 2016
Outcome of the First wwPDB/CCDC/D3R Ligand Validation WorkshopPaul D Adams, Kathleen Aertgeerts, Cary Bauer, et al.
Pageof 4