 ../
|
MPIobj/
|
399
(21 years ago)
by mmeineke:
added dummy files to keep the build deirectories from being pruned.
|
|
obj/
|
400
(21 years ago)
by mmeineke:
*** empty log message ***
|
AtomStamp.cpp
|
982
(20 years ago)
by gezelter:
Changed default orientation in BASS to use Euler angles in the
following order: phi, theta, psi
Removed the ability to set orientation using a unit vector
|
|
AtomStamp.hpp
|
982
(20 years ago)
by gezelter:
Changed default orientation in BASS to use Euler angles in the
following order: phi, theta, psi
Removed the ability to set orientation using a unit vector
|
|
BASS_interface.cpp
|
1153
(20 years ago)
by gezelter:
BASS changes for adding CutoffGroups to molecules. Also restructured
the plethora of cutoff radii into one cutoffRadius and one
switchingRadius. Also removed the useMolecularCutoffs keyword
|
|
BASS_interface.h
|
1153
(20 years ago)
by gezelter:
BASS changes for adding CutoffGroups to molecules. Also restructured
the plethora of cutoff radii into one cutoffRadius and one
switchingRadius. Also removed the useMolecularCutoffs keyword
|
|
BASS_parse.c
|
1156
(20 years ago)
by gezelter:
bugfix for cutoffGroup
|
|
BASS_parse.h
|
378
(21 years ago)
by mmeineke:
This commit was generated by cvs2svn to compensate for changes in r377,
which included commits to RCS files with non-trunk default branches.
|
|
BASSlex.l
|
998
(20 years ago)
by gezelter:
member list fixes for rigid bodies
|
|
BASSyacc.y
|
1153
(20 years ago)
by gezelter:
BASS changes for adding CutoffGroups to molecules. Also restructured
the plethora of cutoff radii into one cutoffRadius and one
switchingRadius. Also removed the useMolecularCutoffs keyword
|
|
BendStamp.cpp
|
790
(20 years ago)
by mmeineke:
fixed a lot of warnings and errors found with SUN's SUNWspro.s1s7
|
|
BendStamp.hpp
|
378
(21 years ago)
by mmeineke:
This commit was generated by cvs2svn to compensate for changes in r377,
which included commits to RCS files with non-trunk default branches.
|
|
BondStamp.cpp
|
790
(20 years ago)
by mmeineke:
fixed a lot of warnings and errors found with SUN's SUNWspro.s1s7
|
|
BondStamp.hpp
|
378
(21 years ago)
by mmeineke:
This commit was generated by cvs2svn to compensate for changes in r377,
which included commits to RCS files with non-trunk default branches.
|
|
Component.cpp
|
828
(20 years ago)
by gezelter:
replace c++ header stuff with more portable c header stuff
Also, mod file fixes and portability changes
|
|
Component.hpp
|
378
(21 years ago)
by mmeineke:
This commit was generated by cvs2svn to compensate for changes in r377,
which included commits to RCS files with non-trunk default branches.
|
|
CutoffGroupStamp.cpp
|
1153
(20 years ago)
by gezelter:
BASS changes for adding CutoffGroups to molecules. Also restructured
the plethora of cutoff radii into one cutoffRadius and one
switchingRadius. Also removed the useMolecularCutoffs keyword
|
|
CutoffGroupStamp.hpp
|
1153
(20 years ago)
by gezelter:
BASS changes for adding CutoffGroups to molecules. Also restructured
the plethora of cutoff radii into one cutoffRadius and one
switchingRadius. Also removed the useMolecularCutoffs keyword
|
|
Globals.cpp
|
1260
(20 years ago)
by gezelter:
Added forceFieldVariant global
|
|
Globals.hpp
|
1260
(20 years ago)
by gezelter:
Added forceFieldVariant global
|
|
LinkedAssign.cpp
|
790
(20 years ago)
by mmeineke:
fixed a lot of warnings and errors found with SUN's SUNWspro.s1s7
|
|
LinkedAssign.hpp
|
378
(21 years ago)
by mmeineke:
This commit was generated by cvs2svn to compensate for changes in r377,
which included commits to RCS files with non-trunk default branches.
|
|
LinkedCommand.cpp
|
790
(20 years ago)
by mmeineke:
fixed a lot of warnings and errors found with SUN's SUNWspro.s1s7
|
|
LinkedCommand.hpp
|
828
(20 years ago)
by gezelter:
replace c++ header stuff with more portable c header stuff
Also, mod file fixes and portability changes
|
|
MakeStamps.cpp
|
1257
(20 years ago)
by gezelter:
Removed debugging printf statements
|
|
MakeStamps.hpp
|
1153
(20 years ago)
by gezelter:
BASS changes for adding CutoffGroups to molecules. Also restructured
the plethora of cutoff radii into one cutoffRadius and one
switchingRadius. Also removed the useMolecularCutoffs keyword
|
|
Makefile.in
|
1233
(20 years ago)
by gezelter:
Config changes for fortran access to SimError
|
|
MoleculeStamp.cpp
|
1268
(20 years ago)
by tim:
roll in progress
|
|
MoleculeStamp.hpp
|
1234
(20 years ago)
by tim:
new rattle algorithm is working
|
|
RigidBodyStamp.cpp
|
1099
(20 years ago)
by gezelter:
Changes for RigidBody dynamics
|
|
RigidBodyStamp.hpp
|
1099
(20 years ago)
by gezelter:
Changes for RigidBody dynamics
|
|
TorsionStamp.cpp
|
790
(20 years ago)
by mmeineke:
fixed a lot of warnings and errors found with SUN's SUNWspro.s1s7
|
|
TorsionStamp.hpp
|
378
(21 years ago)
by mmeineke:
This commit was generated by cvs2svn to compensate for changes in r377,
which included commits to RCS files with non-trunk default branches.
|
|
ZconStamp.cpp
|
1093
(20 years ago)
by tim:
incorporate SMD into ZConstraint,it does not sound a good choice, next commit will seperate SMD and ZConstraint
|
|
ZconStamp.hpp
|
1093
(20 years ago)
by tim:
incorporate SMD into ZConstraint,it does not sound a good choice, next commit will seperate SMD and ZConstraint
|
|
config.h.in
|
1235
(20 years ago)
by gezelter:
forgot to add these
|
|
fError.c
|
1235
(20 years ago)
by gezelter:
forgot to add these
|
|
interface.c
|
1153
(20 years ago)
by gezelter:
BASS changes for adding CutoffGroups to molecules. Also restructured
the plethora of cutoff radii into one cutoffRadius and one
switchingRadius. Also removed the useMolecularCutoffs keyword
|
|
make_nodes.c
|
1256
(20 years ago)
by gezelter:
Fixed indexing bug in stamps
|
|
make_nodes.h
|
1153
(20 years ago)
by gezelter:
BASS changes for adding CutoffGroups to molecules. Also restructured
the plethora of cutoff radii into one cutoffRadius and one
switchingRadius. Also removed the useMolecularCutoffs keyword
|
|
mpiBASS.c
|
1153
(20 years ago)
by gezelter:
BASS changes for adding CutoffGroups to molecules. Also restructured
the plethora of cutoff radii into one cutoffRadius and one
switchingRadius. Also removed the useMolecularCutoffs keyword
|
|
mpiBASS.h
|
1233
(20 years ago)
by gezelter:
Config changes for fortran access to SimError
|
|
node_list.h
|
1153
(20 years ago)
by gezelter:
BASS changes for adding CutoffGroups to molecules. Also restructured
the plethora of cutoff radii into one cutoffRadius and one
switchingRadius. Also removed the useMolecularCutoffs keyword
|
|
parse_interface.h
|
1153
(20 years ago)
by gezelter:
BASS changes for adding CutoffGroups to molecules. Also restructured
the plethora of cutoff radii into one cutoffRadius and one
switchingRadius. Also removed the useMolecularCutoffs keyword
|
|
parse_me.h
|
378
(21 years ago)
by mmeineke:
This commit was generated by cvs2svn to compensate for changes in r377,
which included commits to RCS files with non-trunk default branches.
|
|
parse_tree.c
|
1156
(20 years ago)
by gezelter:
bugfix for cutoffGroup
|
|
parse_tree.h
|
854
(20 years ago)
by mmeineke:
fixed the includes in the Make.dep
|
|
simError.c
|
1233
(20 years ago)
by gezelter:
Config changes for fortran access to SimError
|
|
simError.h
|
1233
(20 years ago)
by gezelter:
Config changes for fortran access to SimError
|
