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bump version to 1.4.0
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zhi-wang committed Feb 22, 2023
1 parent e5ac642 commit 9804f71
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Showing 2 changed files with 4 additions and 4 deletions.
2 changes: 1 addition & 1 deletion ext/ext/y3/erepel_cu1.yaml
Original file line number Diff line number Diff line change
Expand Up @@ -106,7 +106,7 @@ FULL_PAIRWISE_INTERACTION: |
@sizi@, @dmpi@, @vali@, @ci@, @dix@, @diy@, @diz@, @qixx@, @qixy@,
@qixz@, @qiyy@, @qiyz@, @qizz@,
@sizk@, @dmpk@, @valk@, @ck@, @dkx@, @dky@, @dkz@, @qkxx@, @qkxy@,
@qkxz@, @qkyy@, @qkyz@, @qkzz@,
@qkxz@, @qkyy@, @qkyz@, @qkzz@,
e, pgrad);
if CONSTEXPR (do_a)
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6 changes: 3 additions & 3 deletions include/tinker9.h
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Expand Up @@ -5,8 +5,8 @@
/// \addtogroup general
/// \{
#define TINKER9_VERSION_MAJOR 1
#define TINKER9_VERSION_MINOR 3
#define TINKER9_VERSION_PATCH 1
#define TINKER9_VERSION_MINOR 4
#define TINKER9_VERSION_PATCH 0
/// \}

// clang-format off
Expand All @@ -28,7 +28,7 @@
" ### ### ""\n" \
" ### Tinker9 -- Software Tools for Molecular Design ###""\n" \
" ## ##""\n" \
" ## Version 1.3.1 November 2022 ##""\n" \
" ## Version 1.4.0 February 2023 ##""\n" \
" ## ##""\n" \
" ## Copyright (c) Zhi Wang & the Ponder Lab ##""\n" \
" ### All Rights Reserved ###""\n" \
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