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remove trailing whitespace

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This commit is contained in:
Axel Kohlmeyer
2019-02-16 13:31:38 -05:00
parent 551e7a5943
commit 6724ebbdc1
5 changed files with 23 additions and 23 deletions
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14
src/USER-PTM/ptm_polar.cpp
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@ -1,5 +1,5 @@
/*******************************************************************************
* -/_|:|_|_\-
* -/_|:|_|_\-
*
* This code is a modification of D.L. Theobald's QCP rotation code.
* It has been adapted to calculate the polar decomposition of a 3x3 matrix
@ -14,7 +14,7 @@
* USA
*
* dtheobald@brandeis.edu
*
*
* Pu Liu
* Johnson & Johnson Pharmaceutical Research and Development, L.L.C.
* 665 Stockton Drive
@ -22,7 +22,7 @@
* USA
*
* pliu24@its.jnj.com
*
*
*
* If you use this QCP rotation calculation method in a publication, please
* reference:
@ -33,7 +33,7 @@
* Acta Crystallographica A 61(4):478-480.
*
* Pu Liu, Dmitris K. Agrafiotis, and Douglas L. Theobald (2009)
* "Fast determination of the optimal rotational matrix for macromolecular
* "Fast determination of the optimal rotational matrix for macromolecular
* superpositions."
* Journal of Computational Chemistry 31(7):1561-1563.
*
@ -63,7 +63,7 @@
* DATA, OR PROFITS; OR BUSINESS INTERRUPTION) HOWEVER CAUSED AND ON ANY
* THEORY OF LIABILITY, WHETHER IN CONTRACT, STRICT LIABILITY, OR TORT
* (INCLUDING NEGLIGENCE OR OTHERWISE) ARISING IN ANY WAY OUT OF THE USE
* OF THIS SOFTWARE, EVEN IF ADVISED OF THE POSSIBILITY OF SUCH DAMAGE.
* OF THIS SOFTWARE, EVEN IF ADVISED OF THE POSSIBILITY OF SUCH DAMAGE.
*
* Source: started anew.
*
@ -82,7 +82,7 @@
*
* 2016/05/29 QCP method adapted for polar decomposition of a 3x3 matrix,
* for use in Polyhedral Template Matching.
*
*
******************************************************************************/
#include <cmath>
@ -326,7 +326,7 @@ void InnerProduct(double *A, int num, const double (*coords1)[3], double (*coord
A[6] += z1 * x2;
A[7] += z1 * y2;
A[8] += z1 * z2;
A[8] += z1 * z2;
}
}

2
src/USER-PTM/ptm_structure_matcher.cpp
View File

@ -308,7 +308,7 @@ static void check_graphs_graphene( const refdata_t* s,
int num_points,
const double (*ideal_points)[3],
double (*normalized)[3],
int8_t* mapping,
int8_t* mapping,
result_t* res)
{
double G1 = 0, G2 = 0;

10
src/USER-PTM/ptm_voronoi_cell.cpp
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@ -4,19 +4,19 @@ Lawrence Berkeley National Laboratory (subject to receipt of any required
approvals from the U.S. Dept. of Energy). All rights reserved.
Redistribution and use in source and binary forms, with or without
modification, are permitted provided that the following conditions are met:
modification, are permitted provided that the following conditions are met:
(1) Redistributions of source code must retain the above copyright notice, this
list of conditions and the following disclaimer.
list of conditions and the following disclaimer.
(2) Redistributions in binary form must reproduce the above copyright notice,
this list of conditions and the following disclaimer in the documentation
and/or other materials provided with the distribution.
and/or other materials provided with the distribution.
(3) Neither the name of the University of California, Lawrence Berkeley
National Laboratory, U.S. Dept. of Energy nor the names of its contributors may
be used to endorse or promote products derived from this software without
specific prior written permission.
specific prior written permission.
THIS SOFTWARE IS PROVIDED BY THE COPYRIGHT HOLDERS AND CONTRIBUTORS "AS IS" AND
ANY EXPRESS OR IMPLIED WARRANTIES, INCLUDING, BUT NOT LIMITED TO, THE IMPLIED
@ -27,7 +27,7 @@ ANY DIRECT, INDIRECT, INCIDENTAL, SPECIAL, EXEMPLARY, OR CONSEQUENTIAL DAMAGES
LOSS OF USE, DATA, OR PROFITS; OR BUSINESS INTERRUPTION) HOWEVER CAUSED AND ON
ANY THEORY OF LIABILITY, WHETHER IN CONTRACT, STRICT LIABILITY, OR TORT
(INCLUDING NEGLIGENCE OR OTHERWISE) ARISING IN ANY WAY OUT OF THE USE OF THIS
SOFTWARE, EVEN IF ADVISED OF THE POSSIBILITY OF SUCH DAMAGE.
SOFTWARE, EVEN IF ADVISED OF THE POSSIBILITY OF SUCH DAMAGE.
You are under no obligation whatsoever to provide any bug fixes, patches, or
upgrades to the features, functionality or performance of the source code

10
src/USER-PTM/ptm_voronoi_cell.h
View File

@ -4,19 +4,19 @@ Lawrence Berkeley National Laboratory (subject to receipt of any required
approvals from the U.S. Dept. of Energy). All rights reserved.
Redistribution and use in source and binary forms, with or without
modification, are permitted provided that the following conditions are met:
modification, are permitted provided that the following conditions are met:
(1) Redistributions of source code must retain the above copyright notice, this
list of conditions and the following disclaimer.
list of conditions and the following disclaimer.
(2) Redistributions in binary form must reproduce the above copyright notice,
this list of conditions and the following disclaimer in the documentation
and/or other materials provided with the distribution.
and/or other materials provided with the distribution.
(3) Neither the name of the University of California, Lawrence Berkeley
National Laboratory, U.S. Dept. of Energy nor the names of its contributors may
be used to endorse or promote products derived from this software without
specific prior written permission.
specific prior written permission.
THIS SOFTWARE IS PROVIDED BY THE COPYRIGHT HOLDERS AND CONTRIBUTORS "AS IS" AND
ANY EXPRESS OR IMPLIED WARRANTIES, INCLUDING, BUT NOT LIMITED TO, THE IMPLIED
@ -27,7 +27,7 @@ ANY DIRECT, INDIRECT, INCIDENTAL, SPECIAL, EXEMPLARY, OR CONSEQUENTIAL DAMAGES
LOSS OF USE, DATA, OR PROFITS; OR BUSINESS INTERRUPTION) HOWEVER CAUSED AND ON
ANY THEORY OF LIABILITY, WHETHER IN CONTRACT, STRICT LIABILITY, OR TORT
(INCLUDING NEGLIGENCE OR OTHERWISE) ARISING IN ANY WAY OUT OF THE USE OF THIS
SOFTWARE, EVEN IF ADVISED OF THE POSSIBILITY OF SUCH DAMAGE.
SOFTWARE, EVEN IF ADVISED OF THE POSSIBILITY OF SUCH DAMAGE.
You are under no obligation whatsoever to provide any bug fixes, patches, or
upgrades to the features, functionality or performance of the source code

10
src/USER-PTM/ptm_voronoi_config.h
View File

@ -4,19 +4,19 @@ Lawrence Berkeley National Laboratory (subject to receipt of any required
approvals from the U.S. Dept. of Energy). All rights reserved.
Redistribution and use in source and binary forms, with or without
modification, are permitted provided that the following conditions are met:
modification, are permitted provided that the following conditions are met:
(1) Redistributions of source code must retain the above copyright notice, this
list of conditions and the following disclaimer.
list of conditions and the following disclaimer.
(2) Redistributions in binary form must reproduce the above copyright notice,
this list of conditions and the following disclaimer in the documentation
and/or other materials provided with the distribution.
and/or other materials provided with the distribution.
(3) Neither the name of the University of California, Lawrence Berkeley
National Laboratory, U.S. Dept. of Energy nor the names of its contributors may
be used to endorse or promote products derived from this software without
specific prior written permission.
specific prior written permission.
THIS SOFTWARE IS PROVIDED BY THE COPYRIGHT HOLDERS AND CONTRIBUTORS "AS IS" AND
ANY EXPRESS OR IMPLIED WARRANTIES, INCLUDING, BUT NOT LIMITED TO, THE IMPLIED
@ -27,7 +27,7 @@ ANY DIRECT, INDIRECT, INCIDENTAL, SPECIAL, EXEMPLARY, OR CONSEQUENTIAL DAMAGES
LOSS OF USE, DATA, OR PROFITS; OR BUSINESS INTERRUPTION) HOWEVER CAUSED AND ON
ANY THEORY OF LIABILITY, WHETHER IN CONTRACT, STRICT LIABILITY, OR TORT
(INCLUDING NEGLIGENCE OR OTHERWISE) ARISING IN ANY WAY OUT OF THE USE OF THIS
SOFTWARE, EVEN IF ADVISED OF THE POSSIBILITY OF SUCH DAMAGE.
SOFTWARE, EVEN IF ADVISED OF THE POSSIBILITY OF SUCH DAMAGE.
You are under no obligation whatsoever to provide any bug fixes, patches, or
upgrades to the features, functionality or performance of the source code