q4md-forcefieldtools.org



R.E.D. Server Development 2.0 is about to be released.
The q4md-forcefield tools 2.0 are about to be released.
R.E.D. Server is going to be retired.

GNU GPL 3.0
-->   News   <--
 
  Chemistry Nobel Prizes
  R.E.D.
  R.E.D. Server
  R.E.D. Server Dev
  AmberTools 19
  GAMESS Sept 2018 R3
  Firefly 8.2.0
  Gaussian 16 B.01
 
-->   Contact us   <--
 
email
 
-->   Why Us?   <--
 
q4md-forcefieldtools an Internet site devoted to the development of empirical force fields such as AMBER, CHARMM, GLYCAM and OPLS. It combines resources (programs, database and tutorials) useful in atomic charge derivation, force field library building and force field parameter development.
q4md-forcefieldtools stands for tools related to atomic charge values, force field libraries and force field parameters required in 'QM-MM-MD' simulations. q4md also stands for 'Charge for MD simulations'.
 
-->   Our Projects   <--
 
R.E.D.

The R.E.D. tools allow RESP and ESP charge derivation and force field library building for new molecules and molecular fragments.


R.E.D.S.

R.E.D. Server is an Internet service designed to derive RESP and ESP charges and to build force field libraries for new molecules and molecular fragments.


R.E.DD.B.

R.E.DD.B. is a database of RESP and ESP charges and force field libraries for small molecules and molecular fragments.


R.E.DD.B. 2t

R.E.DD.B. Bis & test allows performing blind tests and learning how a project submission has to be carried out in R.E.DD.B.


AmberFFC

AmberFFC, a flexible program to convert AMBER and GLYCAM force fields for use with commercial molecular modeling packages.


FFParmDev

FFParmDev allows developing new force field parameters.

 

Last update of the q4md-forcefieldtools home page: March 26th, 2019.

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* This website is managed and hosted by the Université de Picardie - Jules Verne, Chemin du Thil, 80025 Amiens Cedex 1. Phone: +33-(0)3-2282-7264.
   N°Siret: 19 8013443 00017,  President: M. Benlahsen,  N°CNIL: 1316263

* Ce site est geré et hébergé par l’Université de Picardie - Jules Verne, Chemin du Thil, 80025 Amiens Cedex 1. Telephone: +33-(0)3-2282-7264.
   N°Siret: 19 8013443 00017,  Président: M. Benlahsen,  N°CNIL: 1316263