Annie, is it working now?
Christoph On Wednesday, May 10, 2023 at 1:45:42 PM UTC-6 [email protected] wrote: > get it, thanks for your explain, I will try it. > > On Thu, May 11, 2023 at 3:44 AM Christoph Junghans <[email protected]> > wrote: > >> >> >> On Wed, May 10, 2023 at 1:40 PM Annie Wu <[email protected]> wrote: >> >>> If I change the volume to two time, how could I make sure the density is >>> correct? since I use nve to control the density and use pressure correction >>> to adjust the pressure. >>> >> Sorry, I meant, take your original box and stack 8 of them together (2 in >> each dimension), so you have the same density. >> >> Christoph >> >> >>> >>> On Thu, May 11, 2023 at 3:32 AM Christoph Junghans <[email protected]> >>> wrote: >>> >>>> >>>> >>>> On Wed, May 10, 2023 at 1:00 PM Annie Wu <[email protected]> wrote: >>>> >>>>> [image: 截屏2023-05-11 02.58.44.png] >>>>> I change the cutoff, but I think it's not very reasonable, I change it >>>>> to 0.35,it could run but with a new error, I have change table_begin for >>>>> 1-2 potential, but not very useful, is there any command I could change? >>>>> >>>> If changing the cutoff isn't reasonable, just make the simulation box >>>> bigger by a factor 2 in each direction. >>>> >>>> Christoph >>>> >>>> >>>>> >>>>> On Thu, May 11, 2023 at 2:08 AM Christoph Junghans <[email protected]> >>>>> wrote: >>>>> >>>>>> >>>>>> >>>>>> On Wed, May 10, 2023 at 12:01 PM Annie Wu <[email protected]> >>>>>> wrote: >>>>>> >>>>>>> I change the data file with molecular id and added a topol.xml file, >>>>>>> updating the new attachment, really appreciate your reply, could you >>>>>>> have a >>>>>>> look at my files? Thanks really alot. >>>>>>> >>>>>>> On Thu, May 11, 2023 at 1:40 AM Annie Wu <[email protected]> >>>>>>> wrote: >>>>>>> >>>>>>>> Running critical command 'csg_stat --nt 6 --options >>>>>>>> /usr/local/share/votca/csg-tutorials/spce/ibi_lammps/try-ibi-lammps/settings.xml >>>>>>>> >>>>>>>> --top topol.xml --trj traj.dump --begin 0 --first-frame 0' >>>>>>>> begin to calculate distribution functions >>>>>>>> # of bonded interactions: 0 >>>>>>>> # of non-bonded interactions: 3 >>>>>>>> I have 4000 beads in 800 molecules >>>>>>>> Reading frame, timestep 10000 >>>>>>>> an error occurred: >>>>>>>> The max of interaction "CG1-CG1" bigger is than half the box. >>>>>>>> >>>>>>> This error means that the max of the CG1-CG1 interaction is larger >>>>>> than 1/2 box, which due to minimum image convention is not good, so >>>>>> suggest >>>>>> use a bigger box or a smaller cutoff. >>>>>> >>>>>> >>>>>>>> Callstack: >>>>>>>> /usr/local/share/votca/scripts/inverse/inverse.sh - linenumber 266 >>>>>>>> do_external - linenumber 177 in >>>>>>>> /usr/local/share/votca/scripts/inverse/functions_common.sh >>>>>>>> /usr/local/share/votca/scripts/inverse/update_ibi.sh - >>>>>>>> linenumber 31 >>>>>>>> for_all - linenumber 22 (see 'csg_call --cat function >>>>>>>> for_all') >>>>>>>> do_external - linenumber 19 (see 'csg_call >>>>>>>> --cat function do_external') >>>>>>>> >>>>>>>> /usr/local/share/votca/scripts/inverse/calc_rdf_generic.sh - >>>>>>>> linenumber 84 >>>>>>>> critical - linenumber 4 (see 'csg_call >>>>>>>> --cat function critical') >>>>>>>> die - linenumber 2 (see 'csg_call >>>>>>>> --cat function die') >>>>>>>> >>>>>>>> ########################################################################################################################################################################################### >>>>>>>> # >>>>>>>> >>>>>>>> >>>>>>>> # >>>>>>>> # ERROR: >>>>>>>> >>>>>>>> >>>>>>>> # >>>>>>>> # critical: 'csg_stat --nt 6 --options >>>>>>>> /usr/local/share/votca/csg-tutorials/spce/ibi_lammps/try-ibi-lammps/settings.xml >>>>>>>> >>>>>>>> --top topol.xml --trj traj.dump --begin 0 --first-frame 0' failed # >>>>>>>> # For details see the logfile >>>>>>>> /usr/local/share/votca/csg-tutorials/spce/ibi_lammps/try-ibi-lammps/inverse.log >>>>>>>> >>>>>>>> >>>>>>>> >>>>>>>> # >>>>>>>> # >>>>>>>> >>>>>>>> >>>>>>>> # >>>>>>>> >>>>>>>> ########################################################################################################################################################################################### >>>>>>>> die: (called from 2209634) CSG_MASTER_PID is 2203960 >>>>>>>> die: pids to kill: 2203960 2209464 2209620 2209634 >>>>>>>> >>>>>>>> ------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------- >>>>>>>> I have added a topol.xml with a new error, I have <min><max>and >>>>>>>> <table_begin>, is there get some effect by the bond and angle? but I >>>>>>>> did >>>>>>>> not add any coefficient for bond and angle in the input file, for this >>>>>>>> error, could you give some suggestions? Thanks again for your time. >>>>>>>> >>>>>>>> >>>>>>>> On Thu, May 11, 2023 at 12:49 AM Annie Wu <[email protected]> >>>>>>>> wrote: >>>>>>>> >>>>>>>>> But the data I used include the molecular id, in the traj.dump >>>>>>>>> also includes the molecular information, so I really want to figure >>>>>>>>> this >>>>>>>>> out, if it's possible could anyone try my package? >>>>>>>>> >>>>>>>>> On Thu, May 11, 2023 at 12:15 AM Christoph Junghans < >>>>>>>>> [email protected]> wrote: >>>>>>>>> >>>>>>>>>> Well, it segfaults, which isn't good. >>>>>>>>>> >>>>>>>>>> But it also says: >>>>>>>>>> 0 beads in 0 molecules >>>>>>>>>> so VOTCA has 0 molecules, which is wrong as well. >>>>>>>>>> >>>>>>>>>> The problem is that lammps' data file has no molecular >>>>>>>>>> information, but votca needs that. >>>>>>>>>> The easiest way to fix that is to use a xml topology file instead. >>>>>>>>>> Example: >>>>>>>>>> https://github.com/votca/votca/blob/master/csg-tutorials/propane/imc-ibiintra/topology.xml >>>>>>>>>> Documentation here: >>>>>>>>>> https://www.votca.org/csg/input_files.html#advanced-topology-handling >>>>>>>>>> >>>>>>>>>> >>>>>>>>>> >>>>>>>>>> On Wed, May 10, 2023 at 9:59 AM Annie Wu <[email protected]> >>>>>>>>>> wrote: >>>>>>>>>> >>>>>>>>>>> begin to calculate distribution functions >>>>>>>>>>> # of bonded interactions: 0 >>>>>>>>>>> # of non-bonded interactions: 3 >>>>>>>>>>> >>>>>>>>>>> WARNING: The votca lammps data reader is only able to read >>>>>>>>>>> lammps files formatted in the following styles: >>>>>>>>>>> angle >>>>>>>>>>> atom >>>>>>>>>>> bond >>>>>>>>>>> full >>>>>>>>>>> molecule >>>>>>>>>>> >>>>>>>>>>> These styles use the following formats in the atom block: >>>>>>>>>>> atom-ID molecule-ID atom-type charge x y z >>>>>>>>>>> atom-ID molecule-ID atom-type charge x y z nx ny nz >>>>>>>>>>> atom-ID molecule-ID atom-type x y z >>>>>>>>>>> atom-ID molecule-ID atom-type x y z nx ny nz >>>>>>>>>>> atom-ID atom-type x y z >>>>>>>>>>> atom-ID atom-type x y z nx ny nz >>>>>>>>>>> >>>>>>>>>>> I have 0 beads in 0 molecules >>>>>>>>>>> >>>>>>>>>>> WARNING: The votca lammps data reader is only able to read >>>>>>>>>>> lammps files formatted in the following styles: >>>>>>>>>>> angle >>>>>>>>>>> atom >>>>>>>>>>> bond >>>>>>>>>>> full >>>>>>>>>>> molecule >>>>>>>>>>> >>>>>>>>>>> These styles use the following formats in the atom block: >>>>>>>>>>> atom-ID molecule-ID atom-type charge x y z >>>>>>>>>>> atom-ID molecule-ID atom-type charge x y z nx ny nz >>>>>>>>>>> atom-ID molecule-ID atom-type x y z >>>>>>>>>>> atom-ID molecule-ID atom-type x y z nx ny nz >>>>>>>>>>> atom-ID atom-type x y z >>>>>>>>>>> atom-ID atom-type x y z nx ny nz >>>>>>>>>>> >>>>>>>>>>> >>>>>>>>>>> WARNING: The votca lammps data reader is only able to read >>>>>>>>>>> lammps files formatted in the following styles: >>>>>>>>>>> angle >>>>>>>>>>> atom >>>>>>>>>>> bond >>>>>>>>>>> full >>>>>>>>>>> molecule >>>>>>>>>>> >>>>>>>>>>> These styles use the following formats in the atom block: >>>>>>>>>>> atom-ID molecule-ID atom-type charge x y z >>>>>>>>>>> atom-ID molecule-ID atom-type charge x y z nx ny nz >>>>>>>>>>> atom-ID molecule-ID atom-type x y z >>>>>>>>>>> atom-ID molecule-ID atom-type x y z nx ny nz >>>>>>>>>>> atom-ID atom-type x y z >>>>>>>>>>> atom-ID atom-type x y z nx ny nz >>>>>>>>>>> >>>>>>>>>>> >>>>>>>>>>> WARNING: The votca lammps data reader is only able to read >>>>>>>>>>> lammps files formatted in the following styles: >>>>>>>>>>> angle >>>>>>>>>>> atom >>>>>>>>>>> bond >>>>>>>>>>> full >>>>>>>>>>> molecule >>>>>>>>>>> >>>>>>>>>>> These styles use the following formats in the atom block: >>>>>>>>>>> atom-ID molecule-ID atom-type charge x y z >>>>>>>>>>> atom-ID molecule-ID atom-type charge x y z nx ny nz >>>>>>>>>>> atom-ID molecule-ID atom-type x y z >>>>>>>>>>> atom-ID molecule-ID atom-type x y z nx ny nz >>>>>>>>>>> atom-ID atom-type x y z >>>>>>>>>>> atom-ID atom-type x y z nx ny nz >>>>>>>>>>> >>>>>>>>>>> >>>>>>>>>>> WARNING: The votca lammps data reader is only able to read >>>>>>>>>>> lammps files formatted in the following styles: >>>>>>>>>>> angle >>>>>>>>>>> atom >>>>>>>>>>> bond >>>>>>>>>>> full >>>>>>>>>>> molecule >>>>>>>>>>> >>>>>>>>>>> These styles use the following formats in the atom block: >>>>>>>>>>> atom-ID molecule-ID atom-type charge x y z >>>>>>>>>>> atom-ID molecule-ID atom-type charge x y z nx ny nz >>>>>>>>>>> atom-ID molecule-ID atom-type x y z >>>>>>>>>>> atom-ID molecule-ID atom-type x y z nx ny nz >>>>>>>>>>> atom-ID atom-type x y z >>>>>>>>>>> atom-ID atom-type x y z nx ny nz >>>>>>>>>>> >>>>>>>>>>> >>>>>>>>>>> WARNING: The votca lammps data reader is only able to read >>>>>>>>>>> lammps files formatted in the following styles: >>>>>>>>>>> angle >>>>>>>>>>> atom >>>>>>>>>>> bond >>>>>>>>>>> full >>>>>>>>>>> molecule >>>>>>>>>>> >>>>>>>>>>> These styles use the following formats in the atom block: >>>>>>>>>>> atom-ID molecule-ID atom-type charge x y z >>>>>>>>>>> atom-ID molecule-ID atom-type charge x y z nx ny nz >>>>>>>>>>> atom-ID molecule-ID atom-type x y z >>>>>>>>>>> atom-ID molecule-ID atom-type x y z nx ny nz >>>>>>>>>>> atom-ID atom-type x y z >>>>>>>>>>> atom-ID atom-type x y z nx ny nz >>>>>>>>>>> >>>>>>>>>>> Reading frame, timestep 10000 >>>>>>>>>>> Segmentation fault >>>>>>>>>>> >>>>>>>>>>> __________________________________________________________________________________ >>>>>>>>>>> this is the result after only run the last command, but seems >>>>>>>>>>> nothing information gives out, it really comfuse. >>>>>>>>>>> >>>>>>>>>>> On Wed, May 10, 2023 at 11:45 PM Christoph Junghans < >>>>>>>>>>> [email protected]> wrote: >>>>>>>>>>> >>>>>>>>>>>> >>>>>>>>>>>> >>>>>>>>>>>> On Wed, May 10, 2023 at 9:42 AM Annie Wu <[email protected]> >>>>>>>>>>>> wrote: >>>>>>>>>>>> >>>>>>>>>>>>> [image: 截屏2023-05-10 23.38.52.png]this is the error part in >>>>>>>>>>>>> the log.file, I compare this log with the example, I really think >>>>>>>>>>>>> they are >>>>>>>>>>>>> very similar, I put all the input files in the first attach, hope >>>>>>>>>>>>> could get >>>>>>>>>>>>> some guide about this error. >>>>>>>>>>>>> >>>>>>>>>>>> I would try to run the last command manual to see what is going >>>>>>>>>>>> on: >>>>>>>>>>>> go to step_001 and run >>>>>>>>>>>> $ csg_stat --nt 6 --options ../settings.xml --top spce.data >>>>>>>>>>>> --trj traj.dump --begin 0 --first-frame 0 >>>>>>>>>>>> >>>>>>>>>>>> Christoph >>>>>>>>>>>> >>>>>>>>>>>>> >>>>>>>>>>>>> On Wed, May 10, 2023 at 11:21 PM Annie Wu <[email protected]> >>>>>>>>>>>>> wrote: >>>>>>>>>>>>> >>>>>>>>>>>>>> Thanks for the reply, please check the log.file, it said >>>>>>>>>>>>>> : environment：line 1: 2169250 para wrong "$@", but >>>>>>>>>>>>>> I did not >>>>>>>>>>>>>> see this any place and also compare with the spce example, I >>>>>>>>>>>>>> could run the >>>>>>>>>>>>>> example directly, but this keep error. >>>>>>>>>>>>>> >>>>>>>>>>>>>> On Wednesday, May 10, 2023 at 11:10:37 PM UTC+8 Christoph >>>>>>>>>>>>>> Junghans wrote: >>>>>>>>>>>>>> >>>>>>>>>>>>>>> On Wed, May 10, 2023 at 9:02 AM Annie Wu < >>>>>>>>>>>>>>> [email protected]> wrote: >>>>>>>>>>>>>>> > >>>>>>>>>>>>>>> > Hi votca, >>>>>>>>>>>>>>> > >>>>>>>>>>>>>>> > I work on a two-type CG system, trying to correct the >>>>>>>>>>>>>>> non-bond potential, but file at the first frame, I follow the >>>>>>>>>>>>>>> example in >>>>>>>>>>>>>>> spce:ibi_lammps, I believe I have the same in.file and lammps >>>>>>>>>>>>>>> part in >>>>>>>>>>>>>>> setting.xml, but have no idea why this error comes, any help >>>>>>>>>>>>>>> will be >>>>>>>>>>>>>>> appreciated, I attach the files below. Thanks for your time. >>>>>>>>>>>>>>> >>>>>>>>>>>>>>> What exactly is the error message? >>>>>>>>>>>>>>> >>>>>>>>>>>>>>> > >>>>>>>>>>>>>>> > Best, >>>>>>>>>>>>>>> > Annie >>>>>>>>>>>>>>> > >>>>>>>>>>>>>>> > -- >>>>>>>>>>>>>>> > Join us on Slack: https://join.slack.com/t/votca/signup >>>>>>>>>>>>>>> > --- >>>>>>>>>>>>>>> > You received this message because you are subscribed to >>>>>>>>>>>>>>> the Google Groups "votca" group. >>>>>>>>>>>>>>> > To unsubscribe from this group and stop receiving emails >>>>>>>>>>>>>>> from it, send an email to [email protected]. >>>>>>>>>>>>>>> > To view this discussion on the web visit >>>>>>>>>>>>>>> https://groups.google.com/d/msgid/votca/dd161ab6-aa97-46b4-a1fc-fe2a7f6a4366n%40googlegroups.com. >>>>>>>>>>>>>>> >>>>>>>>>>>>>>> >>>>>>>>>>>>>>> >>>>>>>>>>>>>>> >>>>>>>>>>>>>>> >>>>>>>>>>>>>>> -- >>>>>>>>>>>>>>> Christoph Junghans >>>>>>>>>>>>>>> Web: http://www.compphys.de >>>>>>>>>>>>>>> >>>>>>>>>>>>>> -- >>>>>>>>>>>>>> Join us on Slack: https://join.slack.com/t/votca/signup >>>>>>>>>>>>>> --- >>>>>>>>>>>>>> You received this message because you are subscribed to the >>>>>>>>>>>>>> Google Groups "votca" group. >>>>>>>>>>>>>> To unsubscribe from this group and stop receiving emails from >>>>>>>>>>>>>> it, send an email to [email protected]. >>>>>>>>>>>>>> To view this discussion on the web visit >>>>>>>>>>>>>> https://groups.google.com/d/msgid/votca/82a096c1-49bc-41b7-839a-4f1184db032fn%40googlegroups.com >>>>>>>>>>>>>> >>>>>>>>>>>>>> <https://groups.google.com/d/msgid/votca/82a096c1-49bc-41b7-839a-4f1184db032fn%40googlegroups.com?utm_medium=email&utm_source=footer> >>>>>>>>>>>>>> . >>>>>>>>>>>>>> >>>>>>>>>>>>> -- >>>>>>>>>>>>> Join us on Slack: https://join.slack.com/t/votca/signup >>>>>>>>>>>>> --- >>>>>>>>>>>>> You received this message because you are subscribed to the >>>>>>>>>>>>> Google Groups "votca" group. >>>>>>>>>>>>> To unsubscribe from this group and stop receiving emails from >>>>>>>>>>>>> it, send an email to [email protected]. >>>>>>>>>>>>> To view this discussion on the web visit >>>>>>>>>>>>> https://groups.google.com/d/msgid/votca/CA%2Bkw_mHhHF%3DoOab0XAn%3DNyrNp8BeQ3CGgAOOSS1qk%3DNXcyyjuw%40mail.gmail.com >>>>>>>>>>>>> >>>>>>>>>>>>> <https://groups.google.com/d/msgid/votca/CA%2Bkw_mHhHF%3DoOab0XAn%3DNyrNp8BeQ3CGgAOOSS1qk%3DNXcyyjuw%40mail.gmail.com?utm_medium=email&utm_source=footer> >>>>>>>>>>>>> . >>>>>>>>>>>>> >>>>>>>>>>>> >>>>>>>>>>>> >>>>>>>>>>>> -- >>>>>>>>>>>> Christoph Junghans >>>>>>>>>>>> Web: http://www.compphys.de >>>>>>>>>>>> >>>>>>>>>>>> -- >>>>>>>>>>>> Join us on Slack: https://join.slack.com/t/votca/signup >>>>>>>>>>>> --- >>>>>>>>>>>> You received this message because you are subscribed to the >>>>>>>>>>>> Google Groups "votca" group. >>>>>>>>>>>> To unsubscribe from this group and stop receiving emails from >>>>>>>>>>>> it, send an email to [email protected]. >>>>>>>>>>>> To view this discussion on the web visit >>>>>>>>>>>> https://groups.google.com/d/msgid/votca/CAHG27e6gWuXNnSoLUatqUhy-_AXYVnHwje3GYfCym8LvthRDsw%40mail.gmail.com >>>>>>>>>>>> >>>>>>>>>>>> <https://groups.google.com/d/msgid/votca/CAHG27e6gWuXNnSoLUatqUhy-_AXYVnHwje3GYfCym8LvthRDsw%40mail.gmail.com?utm_medium=email&utm_source=footer> >>>>>>>>>>>> . >>>>>>>>>>>> >>>>>>>>>>> -- >>>>>>>>>>> Join us on Slack: https://join.slack.com/t/votca/signup >>>>>>>>>>> --- >>>>>>>>>>> You received this message because you are subscribed to the >>>>>>>>>>> Google Groups "votca" group. >>>>>>>>>>> To unsubscribe from this group and stop receiving emails from >>>>>>>>>>> it, send an email to [email protected]. >>>>>>>>>>> To view this discussion on the web visit >>>>>>>>>>> https://groups.google.com/d/msgid/votca/CA%2Bkw_mGXF_3ARPMNWb2Dc%2BgrOtntVGVHsqvb2B%2Bmc-OAaCX3WQ%40mail.gmail.com >>>>>>>>>>> >>>>>>>>>>> <https://groups.google.com/d/msgid/votca/CA%2Bkw_mGXF_3ARPMNWb2Dc%2BgrOtntVGVHsqvb2B%2Bmc-OAaCX3WQ%40mail.gmail.com?utm_medium=email&utm_source=footer> >>>>>>>>>>> . >>>>>>>>>>> >>>>>>>>>> >>>>>>>>>> >>>>>>>>>> -- >>>>>>>>>> Christoph Junghans >>>>>>>>>> Web: http://www.compphys.de >>>>>>>>>> >>>>>>>>>> -- >>>>>>>>>> Join us on Slack: https://join.slack.com/t/votca/signup >>>>>>>>>> --- >>>>>>>>>> You received this message because you are subscribed to the >>>>>>>>>> Google Groups "votca" group. >>>>>>>>>> To unsubscribe from this group and stop receiving emails from it, >>>>>>>>>> send an email to [email protected]. >>>>>>>>>> To view this discussion on the web visit >>>>>>>>>> https://groups.google.com/d/msgid/votca/CAHG27e7oh-veUFN0j5ftiPEsBORPRE7X1tQ%3DmsWG8OgTFvxR_g%40mail.gmail.com >>>>>>>>>> >>>>>>>>>> <https://groups.google.com/d/msgid/votca/CAHG27e7oh-veUFN0j5ftiPEsBORPRE7X1tQ%3DmsWG8OgTFvxR_g%40mail.gmail.com?utm_medium=email&utm_source=footer> >>>>>>>>>> . >>>>>>>>>> >>>>>>>>> -- >>>>>>> Join us on Slack: https://join.slack.com/t/votca/signup >>>>>>> --- >>>>>>> You received this message because you are subscribed to the Google >>>>>>> Groups "votca" group. >>>>>>> To unsubscribe from this group and stop receiving emails from it, >>>>>>> send an email to [email protected]. >>>>>>> To view this discussion on the web visit >>>>>>> https://groups.google.com/d/msgid/votca/CA%2Bkw_mG4m_sO%3Dq6JLV29cL4EHwASxS5im0EK9n2g9z4N1Q%3DGuA%40mail.gmail.com >>>>>>> >>>>>>> <https://groups.google.com/d/msgid/votca/CA%2Bkw_mG4m_sO%3Dq6JLV29cL4EHwASxS5im0EK9n2g9z4N1Q%3DGuA%40mail.gmail.com?utm_medium=email&utm_source=footer> >>>>>>> . >>>>>>> >>>>>> >>>>>> >>>>>> -- >>>>>> Christoph Junghans >>>>>> Web: http://www.compphys.de >>>>>> >>>>>> -- >>>>>> Join us on Slack: https://join.slack.com/t/votca/signup >>>>>> --- >>>>>> You received this message because you are subscribed to the Google >>>>>> Groups "votca" group. >>>>>> To unsubscribe from this group and stop receiving emails from it, >>>>>> send an email to [email protected]. >>>>>> To view this discussion on the web visit >>>>>> https://groups.google.com/d/msgid/votca/CAHG27e7YKBag%3DtuaNw3O96HFm_H6BNOMFcVR5x4BhSoaBT5wMA%40mail.gmail.com >>>>>> >>>>>> <https://groups.google.com/d/msgid/votca/CAHG27e7YKBag%3DtuaNw3O96HFm_H6BNOMFcVR5x4BhSoaBT5wMA%40mail.gmail.com?utm_medium=email&utm_source=footer> >>>>>> . >>>>>> >>>>> -- >>>>> Join us on Slack: https://join.slack.com/t/votca/signup >>>>> --- >>>>> You received this message because you are subscribed to the Google >>>>> Groups "votca" group. >>>>> To unsubscribe from this group and stop receiving emails from it, send >>>>> an email to [email protected]. >>>>> To view this discussion on the web visit >>>>> https://groups.google.com/d/msgid/votca/CA%2Bkw_mGe4os20hhAxbrsNjmEiwfYoGj2ggw%3DvV_HcfBLWmPDYg%40mail.gmail.com >>>>> >>>>> <https://groups.google.com/d/msgid/votca/CA%2Bkw_mGe4os20hhAxbrsNjmEiwfYoGj2ggw%3DvV_HcfBLWmPDYg%40mail.gmail.com?utm_medium=email&utm_source=footer> >>>>> . >>>>> >>>> >>>> >>>> -- >>>> Christoph Junghans >>>> Web: http://www.compphys.de >>>> >>>> -- >>>> Join us on Slack: https://join.slack.com/t/votca/signup >>>> --- >>>> You received this message because you are subscribed to the Google >>>> Groups "votca" group. >>>> To unsubscribe from this group and stop receiving emails from it, send >>>> an email to [email protected]. >>>> To view this discussion on the web visit >>>> https://groups.google.com/d/msgid/votca/CAHG27e7w-QAP6iUpL8fbX_FdSBg0GQLzaW15j7aqRVMge6gGwQ%40mail.gmail.com >>>> >>>> <https://groups.google.com/d/msgid/votca/CAHG27e7w-QAP6iUpL8fbX_FdSBg0GQLzaW15j7aqRVMge6gGwQ%40mail.gmail.com?utm_medium=email&utm_source=footer> >>>> . >>>> >>> -- >>> Join us on Slack: https://join.slack.com/t/votca/signup >>> --- >>> You received this message because you are subscribed to the Google >>> Groups "votca" group. >>> To unsubscribe from this group and stop receiving emails from it, send >>> an email to [email protected]. >>> To view this discussion on the web visit >>> https://groups.google.com/d/msgid/votca/CA%2Bkw_mHNFJj4mq13CaySZ%2B6tB4qVqyH1BJ-F9Wj47Mdo%3D6z%3DOw%40mail.gmail.com >>> >>> <https://groups.google.com/d/msgid/votca/CA%2Bkw_mHNFJj4mq13CaySZ%2B6tB4qVqyH1BJ-F9Wj47Mdo%3D6z%3DOw%40mail.gmail.com?utm_medium=email&utm_source=footer> >>> . >>> >> >> >> -- >> Christoph Junghans >> Web: http://www.compphys.de >> >> -- >> Join us on Slack: https://join.slack.com/t/votca/signup >> --- >> > You received this message because you are subscribed to a topic in the >> Google Groups "votca" group. >> To unsubscribe from this topic, visit >> https://groups.google.com/d/topic/votca/iNOeKsNdb_M/unsubscribe. >> To unsubscribe from this group and all its topics, send an email to >> [email protected]. >> To view this discussion on the web visit >> https://groups.google.com/d/msgid/votca/CAHG27e4EzZpt_a2z_oTGUyenCzv-tXAR4po4-SrutpPkGDy0fQ%40mail.gmail.com >> >> <https://groups.google.com/d/msgid/votca/CAHG27e4EzZpt_a2z_oTGUyenCzv-tXAR4po4-SrutpPkGDy0fQ%40mail.gmail.com?utm_medium=email&utm_source=footer> >> . >> > -- Join us on Slack: https://join.slack.com/t/votca/signup --- You received this message because you are subscribed to the Google Groups "votca" group. To unsubscribe from this group and stop receiving emails from it, send an email to [email protected]. To view this discussion on the web visit https://groups.google.com/d/msgid/votca/60707820-6532-47b1-9d09-56b072d3c097n%40googlegroups.com.
