 ../
|
obj/
|
1240
(20 years ago)
by gezelter:
Initial import of SHAPES code
|
|
samples/
|
1310
(20 years ago)
by chrisfen:
Added 2 new samples
|
FST_semi_memo.c
|
1294
(20 years ago)
by chrisfen:
Removed some unnecessary C functions from the SHT code
|
|
FST_semi_memo.h
|
1294
(20 years ago)
by chrisfen:
Removed some unnecessary C functions from the SHT code
|
|
GridBuilder.cpp
|
1308
(20 years ago)
by chrisfen:
Fixed the phi grid range for the final time (hopefully)
|
|
GridBuilder.hpp
|
1287
(20 years ago)
by chrisfen:
Major progress towards inclusion of spherical harmonic transform capability - still having some build issues...
|
|
LJ.vdw
|
1244
(20 years ago)
by gezelter:
Migrated vdw files from OOPSE
|
|
Make.dep
|
1295
(20 years ago)
by gezelter:
renamed forcer, modified factorial, fixed makefile
|
|
Makefile
|
1300
(20 years ago)
by gezelter:
Fixes for visualizer for amira
|
|
MatVec3.c
|
1271
(20 years ago)
by gezelter:
Major changes for rigidbodies
|
|
MatVec3.h
|
1271
(20 years ago)
by gezelter:
Major changes for rigidbodies
|
|
PDBReader.cpp
|
1240
(20 years ago)
by gezelter:
Initial import of SHAPES code
|
|
PDBReader.hpp
|
1240
(20 years ago)
by gezelter:
Initial import of SHAPES code
|
|
RigidBody.cpp
|
1292
(20 years ago)
by chrisfen:
Spherical harmonic tranformations are fully integrated and working
|
|
RigidBody.hpp
|
1287
(20 years ago)
by chrisfen:
Major progress towards inclusion of spherical harmonic transform capability - still having some build issues...
|
|
SHAPE.cpp
|
1300
(20 years ago)
by gezelter:
Fixes for visualizer for amira
|
|
SHAPE.hpp
|
1300
(20 years ago)
by gezelter:
Fixes for visualizer for amira
|
|
SHFunc.cpp
|
1309
(20 years ago)
by chrisfen:
Coefficients are now multiplied by the normalization factor - no longer do we need normalization in the visualizer
|
|
SHFunc.hpp
|
1309
(20 years ago)
by chrisfen:
Coefficients are now multiplied by the normalization factor - no longer do we need normalization in the visualizer
|
|
SphereHarm.cpp
|
1313
(20 years ago)
by chrisfen:
Tolerance input is accepted with the -t flag (default 0.01)
|
|
SphereHarm.hpp
|
1313
(20 years ago)
by chrisfen:
Tolerance input is accepted with the -t flag (default 0.01)
|
|
VDWAtom.cpp
|
1240
(20 years ago)
by gezelter:
Initial import of SHAPES code
|
|
VDWAtom.hpp
|
1240
(20 years ago)
by gezelter:
Initial import of SHAPES code
|
|
amber99.vdw
|
1244
(20 years ago)
by gezelter:
Migrated vdw files from OOPSE
|
|
calc_shapes.f90
|
1314
(20 years ago)
by gezelter:
started functions
|
|
charmm27.vdw
|
1244
(20 years ago)
by gezelter:
Migrated vdw files from OOPSE
|
|
cospmls.c
|
1287
(20 years ago)
by chrisfen:
Major progress towards inclusion of spherical harmonic transform capability - still having some build issues...
|
|
cospmls.h
|
1289
(20 years ago)
by chrisfen:
Fixed linking specification issues
|
|
gaff.vdw
|
1244
(20 years ago)
by gezelter:
Migrated vdw files from OOPSE
|
|
makeweights.c
|
1287
(20 years ago)
by chrisfen:
Major progress towards inclusion of spherical harmonic transform capability - still having some build issues...
|
|
makeweights.h
|
1289
(20 years ago)
by chrisfen:
Fixed linking specification issues
|
|
naive_synthesis.c
|
1287
(20 years ago)
by chrisfen:
Major progress towards inclusion of spherical harmonic transform capability - still having some build issues...
|
|
naive_synthesis.h
|
1287
(20 years ago)
by chrisfen:
Major progress towards inclusion of spherical harmonic transform capability - still having some build issues...
|
|
oplsaal.vdw
|
1244
(20 years ago)
by gezelter:
Migrated vdw files from OOPSE
|
|
pmls.c
|
1287
(20 years ago)
by chrisfen:
Major progress towards inclusion of spherical harmonic transform capability - still having some build issues...
|
|
pmls.h
|
1287
(20 years ago)
by chrisfen:
Major progress towards inclusion of spherical harmonic transform capability - still having some build issues...
|
|
primitive.c
|
1287
(20 years ago)
by chrisfen:
Major progress towards inclusion of spherical harmonic transform capability - still having some build issues...
|
|
primitive.h
|
1287
(20 years ago)
by chrisfen:
Major progress towards inclusion of spherical harmonic transform capability - still having some build issues...
|
|
seminaive.c
|
1287
(20 years ago)
by chrisfen:
Major progress towards inclusion of spherical harmonic transform capability - still having some build issues...
|
|
seminaive.h
|
1287
(20 years ago)
by chrisfen:
Major progress towards inclusion of spherical harmonic transform capability - still having some build issues...
|
|
shaper.cpp
|
1313
(20 years ago)
by chrisfen:
Tolerance input is accepted with the -t flag (default 0.01)
|
|
shaper.ggo
|
1311
(20 years ago)
by chrisfen:
Recentering of the visualized potentials, adding tolerance option
|
|
shaperCmd.c
|
1312
(20 years ago)
by chrisfen:
Setting up shaper to accept a tolerance
|
|
shaperCmd.h
|
1312
(20 years ago)
by chrisfen:
Setting up shaper to accept a tolerance
|
|
visualizer.cpp
|
1311
(20 years ago)
by chrisfen:
Recentering of the visualized potentials, adding tolerance option
|
|
visualizer.ggo
|
1300
(20 years ago)
by gezelter:
Fixes for visualizer for amira
|
|
visualizerCmd.c
|
1300
(20 years ago)
by gezelter:
Fixes for visualizer for amira
|
|
visualizerCmd.h
|
1300
(20 years ago)
by gezelter:
Fixes for visualizer for amira
|
