English
 
Help Privacy Policy Disclaimer
  Advanced SearchBrowse

Item

ITEM ACTIONSEXPORT
 
 
DownloadE-Mail
 Local TagsRelease HistoryDetailsSummary
  CHARMM36m: An improved force field for folded and intrinsically disordered proteins.

Huang, J., Rauscher, S., Nawrocki, G., Ran, T., Feig, M., de Groot, B. L., et al. (2017). CHARMM36m: An improved force field for folded and intrinsically disordered proteins. Nature Methods, 14(1), 71-73. doi:10.1038/nmeth.4067.

Item is

 

show all hide all

Basic

show hide
Item Permalink: https://hdl.handle.net/11858/00-001M-0000-002C-11D6-A Version Permalink: https://hdl.handle.net/11858/00-001M-0000-002C-6466-2
Genre: Journal Article

Files

show Files
hide Files
:
2367828.pdf (Publisher version), 382KB
View   Save
File Permalink:
https://hdl.handle.net/11858/00-001M-0000-002C-6467-F
Name:
2367828.pdf
Description:
-
OA-Status:
Visibility:
Public
MIME-Type / Checksum:
application/pdf / [MD5]
Technical Metadata:
View
Copyright Date:
-
Copyright Info:
-
License:
-
:
2367828_Suppl.pdf (Supplementary material), 5MB
View   Save
File Permalink:
https://hdl.handle.net/11858/00-001M-0000-002C-6468-D
Name:
2367828_Suppl.pdf
Description:
-
OA-Status:
Visibility:
Public
MIME-Type / Checksum:
application/pdf / [MD5]
Technical Metadata:
View
Copyright Date:
-
Copyright Info:
-
License:
-

Locators

show

Creators

show
hide
 Creators:
Huang, J., Author
Rauscher, S.1, Author           
Nawrocki, G., Author
Ran, T., Author
Feig, M., Author
de Groot, B. L.2, Author           
Grubmüller, H.1, Author           
MacKerell, A. D., Author
Affiliations:
1Department of Theoretical and Computational Biophysics, MPI for Biophysical Chemistry, Max Planck Society, ou_578631              
2Research Group of Computational Biomolecular Dynamics, MPI for biophysical chemistry, Max Planck Society, ou_578573              

Content

show
hide
Free keywords: -
 Abstract: The all-atom additive CHARMM36 protein force field is widely used in molecular modeling and simulations. We present its refinement, CHARMM36m (http://mackerell.umaryland.edu/charmm_ff.shtml), with improved accuracy in generating polypeptide backbone conformational ensembles for intrinsically disordered peptides and proteins.

Details

show
hide
Language(s): eng - English
 Dates: 2016-11-072017-01
 Publication Status: Issued
 Pages: -
 Publishing info: -
 Table of Contents: -
 Rev. Type: Peer
 Identifiers: DOI: 10.1038/nmeth.4067
 Degree: -

Event

show

Legal Case

show

Project information

show

Source 1

show
hide
Title: Nature Methods
Source Genre: Journal
 Creator(s):
Affiliations:
Publ. Info: -
Pages: - Volume / Issue: 14 (1) Sequence Number: - Start / End Page: 71 - 73 Identifier: -