biod.pnpi.spb.ru
/
alexxy
/
gromacs.git
/ history
commit
grep
author
committer
pickaxe
?
search:
re
summary
|
shortlog
|
log
|
commit
|
commitdiff
|
tree
first ⋅ prev ⋅
next
Redefine the default boolean type to gmx_bool.
[alexxy/gromacs.git]
/
src
/
gmxlib
/
pdbio.c
2010-08-25
Rossen Apostolov
Redefine the default boolean type to gmx_bool.
blob
|
commitdiff
|
raw
2010-08-23
Rossen Apostolov
Merge branch 'release-4-5-patches' of git.gromacs.org...
blob
|
commitdiff
|
raw
|
diff to current
2010-08-22
Erik Lindahl
Replaced all occurences of str(n)casecmp with gmx_str...
blob
|
commitdiff
|
raw
|
diff to current
2010-08-17
Michael Shirts
Merge branch 'release-4-5-patches' of git@git.gromacs...
blob
|
commitdiff
|
raw
|
diff to current
2010-08-12
Rossen Apostolov
Merge branch 'release-4-5-patches' of git.gromacs.org...
blob
|
commitdiff
|
raw
|
diff to current
2010-08-12
Erik Lindahl
Removed extra TER records after chains we think are...
blob
|
commitdiff
|
raw
|
diff to current
2010-08-02
Erik Lindahl
Merge branch 'release-4-5-patches' of git.gromacs.org...
blob
|
commitdiff
|
raw
|
diff to current
2010-08-02
Erik Lindahl
Modified TER record writing behaviour (only add after...
blob
|
commitdiff
|
raw
|
diff to current
2010-07-27
Erik Lindahl
Modified PDB io code to merely store the chain _identif...
blob
|
commitdiff
|
raw
|
diff to current
2010-07-10
Michael Shirts
Fixed minor formatting conflict.
blob
|
commitdiff
|
raw
|
diff to current
2010-07-02
David van der Spoel
Merge branch 'master' of git.gromacs.org:gromacs
blob
|
commitdiff
|
raw
|
diff to current
2010-07-01
Sander Pronk
More thread safety fixes in gmxlib.
blob
|
commitdiff
|
raw
|
diff to current
2010-06-09
Gerrit Groenhof
Merge branch 'master' into qmmm
blob
|
commitdiff
|
raw
|
diff to current
2010-05-19
David van der Spoel
Merge branch 'master' of git.gromacs.org:gromacs
blob
|
commitdiff
|
raw
|
diff to current
2010-05-19
David van der Spoel
Added check in read_pdb for existence of t_resinfo...
blob
|
commitdiff
|
raw
|
diff to current
2010-04-27
Berk Hess
resolved merge conflicts
blob
|
commitdiff
|
raw
|
diff to current
2010-04-06
David van der Spoel
Revert "Added argument rtpname to t_atoms_set_resinfo...
blob
|
commitdiff
|
raw
|
diff to current
2010-04-06
David van der Spoel
Added argument rtpname to t_atoms_set_resinfo to avoid...
blob
|
commitdiff
|
raw
|
diff to current
2010-03-02
Roland Schulz
Merge branch 'release-4-0-patches'
blob
|
commitdiff
|
raw
|
diff to current
2010-02-06
David van der Spoel
Replaced two strcpy by strncpy in pdbio.c to prevent...
blob
|
commitdiff
|
raw
|
diff to current
2010-02-05
David van der Spoel
Merge branch 'master' of git.gromacs.org:gromacs
blob
|
commitdiff
|
raw
|
diff to current
2010-02-03
Michael Shirts
Merge branch 'master' of git@git.gromacs.org:gromacs
blob
|
commitdiff
|
raw
|
diff to current
2010-02-01
Berk Hess
TER entries in pdb file now get translated into chain...
blob
|
commitdiff
|
raw
|
diff to current
2009-09-23
Michael Shirts
Merge branch 'master' of git@git.gromacs.org:gromacs
blob
|
commitdiff
|
raw
|
diff to current
2009-09-14
David van der Spoel
Merge branch 'master' of git@git.gromacs.org:gromacs
blob
|
commitdiff
|
raw
|
diff to current
2009-09-14
David van der Spoel
Merge branch 'master' of git.gromacs.org:gromacs
blob
|
commitdiff
|
raw
|
diff to current
2009-09-12
Roland Schulz
Merge branch 'master' of git@git.gromacs.org:gromacs
blob
|
commitdiff
|
raw
|
diff to current
2009-09-09
Michael Shirts
Merge branch 'master' of git://git.gromacs.org/gromacs
blob
|
commitdiff
|
raw
|
diff to current
2009-09-09
Sander Pronk
Made former atoi (atoi is not thread-safe) strtols...
blob
|
commitdiff
|
raw
|
diff to current
2009-08-30
kasson
Tool merge
blob
|
commitdiff
|
raw
|
diff to current
2009-08-27
David van der Spoel
Merge branch 'master' of git@git.gromacs.org:gromacs
blob
|
commitdiff
|
raw
|
diff to current
2009-08-21
Sander Pronk
Merge branch 'thread_mpi'. Threads should work for...
blob
|
commitdiff
|
raw
|
diff to current
2009-06-27
Sander Pronk
atoi/atof are not thread-safe: replaced all instances...
blob
|
commitdiff
|
raw
|
diff to current
2009-06-04
Erik Lindahl
Removed Id tags from master branch since they will...
blob
|
commitdiff
|
raw
|
diff to current
2009-06-03
teemu
Fixed more compiler errors and warnings for C/C++ compa...
blob
|
commitdiff
|
raw
|
diff to current
2009-06-03
hess
updated for C++ compilation
blob
|
commitdiff
|
raw
|
diff to current
2009-06-03
teemu
Improved compilation (no errors, less warnings) of...
blob
|
commitdiff
|
raw
|
diff to current
2009-04-10
spoel
Added support for writing CONECT records to pdb files...
blob
|
commitdiff
|
raw
|
diff to current
2009-04-10
spoel
Added check for chain id that is zero
blob
|
commitdiff
|
raw
|
diff to current
2009-04-06
spoel
Updated
blob
|
commitdiff
|
raw
|
diff to current
2009-03-17
spoel
Fixed writing of elements in column 77/78
blob
|
commitdiff
|
raw
|
diff to current
2009-03-16
spoel
Added extra field elem in atom record. This does not...
blob
|
commitdiff
|
raw
|
diff to current
2009-03-06
hess
added t_resinfo struct to t_atoms which contains the...
blob
|
commitdiff
|
raw
|
diff to current
2009-02-28
spoel
Updated
blob
|
commitdiff
|
raw
|
diff to current
2008-10-16
hess
fixed bug in ePBC assignment which also caused a compil...
blob
|
commitdiff
|
raw
|
diff to current
2008-10-16
hess
fixed bug in ePBC assignment which also caused a compil...
blob
|
commitdiff
|
raw
|
diff to current
2008-10-10
lindahl
Merged in changes from final 4.0 release into head...
blob
|
commitdiff
|
raw
|
diff to current
2008-10-08
lindahl
Fixed pdb format for 4-char atom names, so that the...
blob
|
commitdiff
|
raw
|
diff to current
2008-09-19
lindahl
Implemented automatic renaming and optional appending...
blob
|
commitdiff
|
raw
|
diff to current
2008-06-27
hess
made atomprop only read a particular database when...
blob
|
commitdiff
|
raw
|
diff to current
2008-06-27
hess
limited the long atom name warnings to 20
blob
|
commitdiff
|
raw
|
diff to current
2008-04-18
spoel
Updated
blob
|
commitdiff
|
raw
|
diff to current
2008-03-28
spoel
Removed library file reading from pdb reading
blob
|
commitdiff
|
raw
|
diff to current
2008-03-11
hess
implemented screw pbc
blob
|
commitdiff
|
raw
|
diff to current
2008-02-15
spoel
Added extra field in the t_atom struct containing atom...
blob
|
commitdiff
|
raw
|
diff to current
2007-07-05
spoel
Removed OXT to O2 renaming
blob
|
commitdiff
|
raw
|
diff to current
2006-05-11
hess
made the pdb box writing a seperate function
blob
|
commitdiff
|
raw
|
diff to current
2006-05-04
spoel
Merged in bugfix from 3.3
blob
|
commitdiff
|
raw
|
diff to current
2006-02-27
spoel
Merged in warning from 3.3
blob
|
commitdiff
|
raw
|
diff to current
2005-09-03
spoel
Merged in changes from the release-3-3-patches tree.
blob
|
commitdiff
|
raw
|
diff to current
2005-06-02
spoel
Fixed output for MEAD
blob
|
commitdiff
|
raw
|
diff to current
2005-03-07
hess
For triclinic boxes box angles of 90.00 are now read...
blob
|
commitdiff
|
raw
|
diff to current
2004-12-26
lindahl
Updated Gromacs #defines to use the GMX_ prefix.
blob
|
commitdiff
|
raw
|
diff to current
2004-09-06
spoel
Replaced the fatal_error routine by a more flexible...
blob
|
commitdiff
|
raw
|
diff to current
2004-06-11
hess
changed HEADER to TITLE
blob
|
commitdiff
|
raw
|
diff to current
2004-01-23
lindahl
Added conditional inclusion of config.h to source files.
blob
|
commitdiff
|
raw
|
diff to current
2003-11-17
spoel
Upped the version to 3.2.0
blob
|
commitdiff
|
raw
|
diff to current
2002-11-06
lindahl
Partial commit of the project to remove all static...
blob
|
commitdiff
|
raw
|
diff to current
2002-06-25
lindahl
Fixed a bug in the pdb-writing code.
blob
|
commitdiff
|
raw
|
diff to current
2002-06-02
spoel
Fixed writing of anisou records
blob
|
commitdiff
|
raw
|
diff to current
2002-04-24
hess
pdb frames are now always surrounded by MODEL with...
blob
|
commitdiff
|
raw
|
diff to current
2002-02-28
spoel
Updated copyrgt wrapper
blob
|
commitdiff
|
raw
|
diff to current
2002-01-31
hess
the bfac field was printed %7.3f iso %6.2f
blob
|
commitdiff
|
raw
|
diff to current
2001-05-14
lindahl
Tagged files with gromacs 3.0 header
blob
|
commitdiff
|
raw
|
diff to current
2001-04-24
anton
fixed typo in text
blob
|
commitdiff
|
raw
|
diff to current
2000-08-28
spoel
Updated format for b-factor, from 6.2 to 7.3 (which...
blob
|
commitdiff
|
raw
|
diff to current
2000-07-26
hess
added some {}
blob
|
commitdiff
|
raw
|
diff to current
2000-07-25
anton
only print box to pdb file if one vector > 0
blob
|
commitdiff
|
raw
|
diff to current
2000-07-20
anton
moved pdbformat from pdbio.c to pdbio.h
blob
|
commitdiff
|
raw
|
diff to current
2000-07-18
anton
cleaned up pdbio and added model numbering
blob
|
commitdiff
|
raw
|
diff to current
2000-05-11
anton
read_atom now accepts atoms->atom==NULL to not read...
blob
|
commitdiff
|
raw
|
diff to current
2000-04-13
spoel
*** empty log message ***
blob
|
commitdiff
|
raw
|
diff to current
2000-04-13
hess
fixed segv by adding check for pdbinfo
blob
|
commitdiff
|
raw
|
diff to current
2000-04-05
spoel
Made modification of occup field to 1 optional in the...
blob
|
commitdiff
|
raw
|
diff to current
2000-03-14
spoel
Modified stxio such that atoms struct entries are copie...
blob
|
commitdiff
|
raw
|
diff to current
2000-02-08
hess
fixed box angles when vector=0
blob
|
commitdiff
|
raw
|
diff to current
2000-01-14
hess
made the record field left aligned
blob
|
commitdiff
|
raw
|
diff to current
1999-11-29
hess
added support for triclinic boxes
blob
|
commitdiff
|
raw
|
diff to current
1999-11-03
hess
copyrgted
blob
|
commitdiff
|
raw
|
diff to current
1999-08-10
hess
removed dummy masses from posre.itp
blob
|
commitdiff
|
raw
|
diff to current
1999-07-28
spoel
Fixed bug in readin anisotropic B factors
blob
|
commitdiff
|
raw
|
diff to current
1999-06-06
spoel
Removec otherwise harmless compiler warnings
blob
|
commitdiff
|
raw
|
diff to current
1999-04-22
anton
removed unused vars, fixed bad_formats
blob
|
commitdiff
|
raw
|
diff to current
1999-04-22
anton
removed check on gromacs remark header for CRYST1 box...
blob
|
commitdiff
|
raw
|
diff to current
1999-03-01
anton
changed %d to %u in pdbformat and pdbformat4
blob
|
commitdiff
|
raw
|
diff to current
1999-02-16
hess
removed unused vars
blob
|
commitdiff
|
raw
|
diff to current
1999-02-12
anton
removed memory leaks with symtab
blob
|
commitdiff
|
raw
|
diff to current
1999-01-29
hess
added Code for insertion of residues to residue differe...
blob
|
commitdiff
|
raw
|
diff to current
1999-01-28
hess
added altloc
blob
|
commitdiff
|
raw
|
diff to current
1998-12-01
spoel
Fixed a number of (compilation) problems. Debugging...
blob
|
commitdiff
|
raw
|
diff to current
next
biod.pnpi.spb.ru / alexxy / gromacs.git / history