Guidelines for the analysis of free energy calculations Journal Article

• Best Open Access

Overview

CU Boulder Authors

• Shirts, Michael R

publication date

• May 1, 2015

has subject area

• Biochemical Phenomena - Molecular Dynamics Simulation
• Biological Science Disciplines - Drug Design
• Biological Science Disciplines - Drug Discovery
• Chemistry - Drug Design
• Chemistry - Drug Discovery
• Computer Simulation
• Computer Simulation - Molecular Dynamics Simulation
• Entropy
• Health Care Quality, Access, and Evaluation - Guidelines as Topic
• Health Services Administration - Guidelines as Topic
• Investigative Techniques - Drug Design
• Investigative Techniques - Drug Discovery
• Models, Chemical
• Models, Molecular - Molecular Dynamics Simulation

has restriction

• green

Date in CU Experts

• September 4, 2015 2:15 AM

Full Author List

• Klimovich PV; Shirts MR; Mobley DL

author count

• 3

citation count

• 373

published in

• Journal of Computer-Aided Molecular Design  Journal

Other Profiles

International Standard Serial Number (ISSN)

• 0920-654X

Electronic International Standard Serial Number (EISSN)

• 1573-4951

Digital Object Identifier (DOI)

• https://doi.org/10.1007/s10822-015-9840-9

Additional Document Info

start page

• 397

end page

• 411

volume

• 29

issue

• 5