*>>>>>> Combined CHARMM All-Hydrogen Topology File for <<<<<<<<< *>>>>>>>>> CHARMM22 Proteins and CHARMM27 Lipids <<<<<<<<<< *from *>>>>>>>>CHARMM22 All-Hydrogen Topology File for Proteins <<<<<< *>>>>>>>>>>>>>>>>>>>>> August 1999 <<<<<<<<<<<<<<<<<<<<<<<<<<<<< *>>>>>>> Direct comments to Alexander D. MacKerell Jr. <<<<<<<<< *>>>>>> 410-706-7442 or email: alex,mmiris.ab.umd.edu <<<<<<<<< *and * \\\ CHARMM27 All-Hydrogen Lipid Topology File /////// * \\\\\\\\\ Developmental ///////////////////////// * Alexander D. MacKerell Jr. * August 1999 * All comments to ADM jr. email: alex,mmiris.ab.umd.edu * telephone: 410-706-7442 * 27 1 ! +++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ ! + Residue topologies/parameters generated by PARATOOL. + ! + + ! + PARATOOL is an interactive tool for generation of force field parameters. + ! + and can be obtained free of charge from + ! + http://bioinf.charite.de/biophys/paratool + ! + + ! + Author: + ! + Jan Saam + ! + Institute of Biochemistry + ! + Charite Berlin + ! + Germany + ! + saam@charite.de + ! + + ! + CITATION: + ! + If you use PARATOOL or topologies/parameters generated by this program, + ! + please cite the following work: + ! + Saam, et al. (2006), ... + ! +++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++ MASS 1 C1 12.01100 C ! MASS 2 H1 1.00800 H ! RESI MOL +0.000 ! type from CHARMM GROUP ATOM C1 C1 -0.360 ! type from CHARMM ATOM H1 H1 +0.090 ! type from CHARMM ATOM H2 H1 +0.090 ! type from CHARMM ATOM H3 H1 +0.090 ! type from CHARMM ATOM H4 H1 +0.090 ! type from CHARMM BOND H1 C1 H2 C1 H3 C1 H4 C1 ANGLE H2 C1 H1 H3 C1 H1 H4 C1 H1 ANGLE H3 C1 H2 H4 C1 H2 H4 C1 H3 PATCHING FIRS NONE LAST NONE END