What is inside the bin folder? And place use the mailing when posting your full install log.
Christoph On Sun, Apr 12, 2020 at 06:15 谢信锐 <[email protected]> wrote: > Hi, > > The path of prefix=WHERE/TO/INSTALL/VOTCA consists of following contents: > > bin include lib share > > > #Noting that running csg_xxx -h (such as csg_fmatch -h ) works, but not > xtp_map and so on! > > > -----Original Messages----- > *From:*"Baumeier, B." <[email protected]> > *Sent Time:*2020-04-12 16:48:51 (Sunday) > *To:* "Jens Wehner" <[email protected]>, "谢信锐" <[email protected]> > *Cc:* "Christoph Junghans" <[email protected]>, "[email protected]" > <[email protected]> > > > *Subject:* Re: Re: Re: Re: Re: Errors > > Which path did you chose for prefix=WHERE/TO/INSTALL/VOTCA? And what is in > this path? > > Get Outlook for Android <https://aka.ms/ghei36> > > ------------------------------ > *From:* 谢信锐 <[email protected]> > *Sent:* Sunday, April 12, 2020 10:34:34 AM > *To:* Jens Wehner <[email protected]> > *Cc:* Christoph Junghans <[email protected]>; Baumeier, B. < > [email protected]>; [email protected] <[email protected]> > *Subject:* Re: Re: Re: Re: Re: Errors > > > Hi, > > a) As follows, I installed the votca > > prefix=WHERE/TO/INSTALL/VOTCA > version=master # or 'stable' or 'v1.4.1' > git clone -b ${version} --recursive https://github.com/votca/votca.git > cd votca > mkdir build > cd build > cmake -DBUILD_CSGAPPS=ON -DBUILD_XTP=ON -DCMAKE_INSTALL_PREFIX=${prefix} .. > make -j4 > make install > > b) I searched the cmake.log and couldn't find it. > > > c) When I run csg_match -h, command 'csg_match' not found. > > > Sincerely! > > > -----Original Messages----- > *From:*"Jens Wehner" <[email protected]> > *Sent Time:*2020-04-12 16:22:35 (Sunday) > *To:* "谢信锐" <[email protected]> > *Cc:* "Christoph Junghans" <[email protected]>, "Baumeier, B." < > [email protected]>, [email protected] > *Subject:* Re: Re: Re: Re: Errors > > HI, > > a) how exactly did you get the latest version of votca? > > b) how did you install it? Can you post the cmake logs? > > c) what happens if you run csg_match -h ? > > Cheers Jens > > Am So., 12. Apr. 2020 um 08:51 Uhr schrieb 谢信锐 <[email protected]>: > > Hi, > > > I have installed the latest version of vocta, > > > the occurrence of error: > > I have installed VOTCA toolkit including both csg and xtp. When I run the > xtp_map in the presence of file position of > votca/xtp-tutorials/GROMACS/Methane, there is a error! > > > xtp_map -t MD_FILES/topol.tpr -c MD_FILES/conf.gro -s system.xml -f > state.hdf5 > > xtp_map: command not found > > what I did: > > I have sourced the VOTCARC.bash; > > xtp_map is in bin/ folder of the installation. > > > How to address this problem? > > Thank you! > > > > > -----Original Messages----- > *From:*"Christoph Junghans" <[email protected]> > *Sent Time:*2020-04-11 20:55:49 (Saturday) > *To:* "谢信锐" <[email protected]> > *Cc:* "Jens Wehner" <[email protected]>, "Baumeier, B." < > [email protected]> > *Subject:* Re: Re: Re: Errors > > > > On Sat, Apr 11, 2020, 06:47 谢信锐 <[email protected]> wrote: > > > Dear Christoph, > > > I have sourced the VOTCARC.bash, but the same problem still occurred! > > Maybe Jens or Bjorn know, both are cc'ed. Please use reply-all from now > on. > > Is there an xtp_map in bin/ folder of the installation? What version of > VOTCA are you using? > > Also could you please post these kind of question on the mailing list, > [email protected], so that others can learn of from it? > > Christoph > > > > > -----Original Messages----- > *From:*"Christoph Junghans" <[email protected]> > *Sent Time:*2020-04-11 20:13:52 (Saturday) > *To:* "谢信锐" <[email protected]> > *Cc:* "Baumeier, B." <[email protected]> > *Subject:* Re: Re: Errors > > > > On Sat, Apr 11, 2020, 05:58 谢信锐 <[email protected]> wrote: > > Hi, > > > Thank you very much! > > > I have installed VOTCA toolkit including both csg and xtp. When I run the > xtp_map in the presence of file position of > votca/xtp-tutorials/GROMACS/Methane, there is a error! > > > xtp_map -t MD_FILES/topol.tpr -c MD_FILES/conf.gro -s system.xml -f > state.hdf5 > > xtp_map: command not found > > Have you sourced VOTCARC? > > Christoph > > > I could not figure out what happened, and maybe I shall add some > definitive command to allow that process? > > > Sincerely! > > > > > > -----Original Messages----- > *From:*"Christoph Junghans" <[email protected]> > *Sent Time:*2020-04-08 20:36:24 (Wednesday) > *To:* "谢信锐" <[email protected]> > *Cc:* [email protected] > *Subject:* Re: Errors > > > > On Wed, Apr 8, 2020 at 02:06 谢信锐 <[email protected]> wrote: > > Hi, > > I have addressed some of errors, but not for CLANG_FORMAT (required > version >= 7.0.1) > > -- The following OPTIONAL packages have not been found: > > As it says here it is optional, so ignore that and go ahead. > > Christoph > > > > * CLANG_FORMAT (required version >= 7.0.1) > > -- Configuring done > -- Generating done > -- Build files have been written to: /home/xxr/votca-xtp/votca/build > > Shall this missing affect next process of installation? > > > Sincerely! > > > Xie Xinrui > > Department of Chemistry > > Zhejiang University > > > -----Original Messages----- > *From:*"谢信锐" <[email protected]> > *Sent Time:*2020-04-08 13:51:31 (Wednesday) > *To:* [email protected] > *Cc:* > *Subject:* Errors > > > > Hi, > > > When I installed the CTP of VOTCA, some errors occurred after inputting > > cmake -DBUILD_CTP=ON -DCMAKE_INSTALL_PREFIX=${prefix} .. > > > The details of errors is shown as follows: > > Boost version: 1.65.1 > -- Found the following Boost libraries: > -- program_options > -- filesystem > -- system > -- Could NOT find MKL (missing: MKL_INCLUDE_DIR MKL_Core_LINK_LIBRARY) > -- Found Eigen3: /usr/lib/cmake/eigen3 > -- Checking for module 'sqlite3' > -- No package 'sqlite3' found > CMake Error at > /usr/share/cmake-3.10/Modules/FindPackageHandleStandardArgs.cmake:137 > (message): > Could NOT find SQLITE3 (missing: SQLITE3_LIBRARY SQLITE3_INCLUDE_DIR) > Call Stack (most recent call first): > /usr/share/cmake-3.10/Modules/FindPackageHandleStandardArgs.cmake:378 > (_FPHSA_FAILURE_MESSAGE) > tools/CMakeModules/FindSQLITE3.cmake:31 > (find_package_handle_standard_args) > CMakeLists.txt:78 (_find_package) > tools/src/libtools/CMakeLists.txt:12 (find_package) > > > -- Configuring incomplete, errors occurred! > > > I'm not familiar with error handling, and guess that some supporting > programs are missing? > > > Sincerely! > > > > > -- > Christoph Junghans > Web: http://www.compphys.de > > -- Christoph Junghans Web: http://www.compphys.de -- You received this message because you are subscribed to the Google Groups "votca" group. 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