Welcome to The Roitberg Research Group

Group News

  • 10/17/2016: Qualifying Exam. Ankita Sarkar will be presenting her PhD proposal on “pH-dependent Conformational Reorganization due to Ionizable Residues in a Hydrophobic Protein Interior”
  • 09/13/2016: Dr. Roitberg is named an Ulam Distinguished Scholar at the Los Alamos National Laboratory.
  • 11/18/2015: Natali Graduated!
    Congratulations Dr. Di Russo!
  • 11/18/2015: New Postdoc We welcome Marcos Serrou do Amaral, Professor do Instituto de Física (INFI) da Universidade Federal do Mato Grosso do Sul, Brazil, who is visiting us for a year with generous funding from the Brazilian National Science Agency (CNPQ).
  • 11/18/2014: New visiting students
    Welcome Mauricio and Jordi!
  • 07/14/2014: Dr. Roitberg is now an ACS fellow!
    Congratulations!
  • 08/10/2014: New group members!
    Welcome Vinicius, Xiang, Giri, Dustin and Ankita.
  • 08/01/2014: Natali received a Procter & Gamble Award!
    More info here. Congratulations!
  • 04/30/2014: Goodbye Rogerio and Claudio!
    The visiting professor and student returned to Brazil after a great year in Gainesville.
  • 04/15/2014: Johan graduated!
    Congratulations Dr. Galindo!
  • 12/19/2013: Dr. Roitberg is now an APS fellow!
    Congratulations!
  • 12/01/2013: Dwight graduated!
    Congratulations Dr. McGee!
  • 11/26/2013: Johan’s J. Phys. Chem. C paper is now online!
    Take a look here.
  • 10/1/2013: Natali won an HHMI fellowship!
    She was awarded an International Student Research Fellowship (more info here). Congratulations!
  • 06/10/2013: New visiting student and professor
    Rogério de Araújo Silva and Prof. Cláudio Nahum Alves are visiting from the Universidade Federal do Pará in Brazil. Welcome!
  • 08/01/2013: Congratulations to the new Roitberg group graduates!
    Dr. Swails, Dr. Miller and Dr. Sabri Dashti
  • 06/01/2013: Take a look at some of the software developed by the group!
    You can now find download links for USRE optimization and parameter fitting in the links section
  • 06/01/2013: Check out our new papers!
    Find the links to our newest four papers here
  • 03/01/2013: Jason won the Peter Kollman Graduate Award in Supercomputing
    Awarded by the COMP Division of the ACS. Find out more here
  • 2/22/2013: Our article on Ru dicarboxylates was just published in the Journal of Computational Chemistry
    Take a look at it by clicking here
  • 01/07/2013: Our oxygen diffusion in myoglobin paper is now available!
    Take a look at it by clicking here
  • 12/31/2012: Welcome Billy, Logan, Cameran and Brendan!
    Dwight had unpaired kids (triplets!) while Billy had only a singlet.
  • 12/12/2012: We got the cover of Langmuir!
    Take a look at our paper on polyelectrolyte dendrimers with the Kleiman and Schanze groups by clicking here
  • 11/12/2012: New paper!
    Take a look at our new paper in Theoretical Chemistry Accounts by clicking here
  • 11/05/2012: Group Meeting
    Billy, Dwight and Juan will present at noon. We’ll meet in LEI 442.
  • 10/28/2012: Group Meeting
    Johan, Shuai and Chad will present at noon. We’ll meet in LEI 442.
  • Group News:
    The MMPBSA.py paper is among the most read in JCTC!
    See the list here
  • 11/19/2012: Group Meeting
    Juan will be presenting on the MM-ISMA paper. We’ll meet at noon in LEI 442.
  • Natali’s pKa paper is now available at PLoS Computational Biology!
    Take a look at it by clicking here
  • 11/02/2012: Oral Exam
    Natali passed her oral and is now a PhD candidate. Congratulations!
  • 10/29/2012: Group Meeting
    Natali will be practicing for the oral qual in the afternoon. We’ll meet in LEI 442.
  • 10/23/2012: Group Meeting
    Marcos Grosso, a visiting member, will be presenting at noon. We’ll meet in LEI 442.
  • 10/17/2012: Group Meeting
    Johan, Shuai and Chad will be presenting at noon. We’ll meet in LEI 442.
  • 10/10/2012: Group Meeting
    Natt, Danial and Dwight will be presenting at noon. We’ll meet in LEI 442.
  • 10/4/2012: Group Meeting
    Juan, Billy and Dwight will be presenting at noon. We’ll meet in LEI 442.
  • 9/26/2012: Group Meeting
    Johan, Shuai and Chad will be presenting at noon. We’ll meet in LEI 442.
  • 9/19/2012: Group Meeting
    Jason and our two visting members, Christina Bergonzo and Dan Roe, will be presenting at noon. We’ll meet in LEI 442.
  • 9/11/2012: Group Meeting
    Danial, Natali and Chad will be presenting at noon. We’ll meet in LEI 442.
  • Danial’s paper on pH REMD is now available in J. Phys. Chem. B!
    Take a look at it by clicking here
  • Jason’s paper is now available in JCTC!
    Take a look at it by clicking here
  • 9/05/2012: Group Meeting
    Billy and Juan will be presenting at noon. We’ll meet in LEI 442.
  • 8/29/2012: Group Meeting
    Johan, Chad and Shuai will be presenting at noon. We’ll meet in LEI 442.
  • Natali won the best participant poster award at the NBCR Summer Institute
    Congrats!
  • 8/22/2012: Group Meeting
    Natt and Danial will be presenting at noon. We’ll meet in LEI 442.
  • Johan’s IR paper is now available at J. Phys. Chem. A!
    Take a look at it by clicking here
  • Our MMPBSA.py paper is now available at JCTC!
    Take a look at it by clicking here
  • 8/15/2012: Group Meeting
    Juan, Billy and Dwight will be presenting at noon. We’ll meet in LEI 442.
  • 8/8/2012: Group Meeting
    Shuai and Chad will be presenting at noon. We’ll meet in the new office (LEI 442).
  • 7/24/2012: Group Meeting
    Natt and Danial will be presenting at noon. We’ll meet in the new office (LEI 442). There will be no group meeting next week.
  • 7/17/2012: Group Meeting
    Billy, Dwight and Juan will be presenting at noon. We’ll meet in the new office (LEI 442).
  • No Group Meeting This Week
    We’ll start moving to the new office 7/10.
  • 7/03/2012: Group Meeting
    Johan, Chad and Shuai will be presenting at noon in the BatCave.
  • 6/26/2012: Group Meeting
    Natt, Danial and Dwight will be presenting at noon in the BatCave.
  • 6/20/2012: Group Meeting
    Juan, Billy and Dwight will be presenting at noon in the BatCave.
  • Billy’s paper is now available in JACS!
    Take a look at it by clicking here
  • 6/13/2012: Group Meeting
    Johan, Shuai and Chad will be presenting at 1.15 pm in the BatCave.
  • The webpage is going live!
    Comments and suggestions are welcome.
  • 6/06/2012: Group Meeting
    Danial, Natali and Dwight will be presenting at 1.15 pm in the BatCave.
  • 5/30/2012: Group Meeting
    Juan, Billy and Dwight will be presenting at 1.15 pm in the BatCave.
  • 5/29/2012: We visited our new offices!
    They are located in the 4th floor of Leigh Hall. They have windows! :)
  • Jason is back from Australia
    We are all expecting kangaroos as presents