possible FAILURE:  check prmtop.new_type.dif
/scratch1/amber14/AmberTools/test/parmed/chamber_prmtop
5025,5028c5025,5028
<   7.0320002812773935E+4  3.0991959086075940E+3  1.5730411891415534E+6
<   1.2254480396417496E+6  1.5350319889737577E+6  1.8962122985815424E+6
<   1.6150318076691339E+6  5.5913203238501586E+5  5.5913203238501586E+5
<   7.5015433968630561E+5  1.2254480396417496E+6  1.5350319889737577E+6
---
>   7.0320002812773819E+4  3.0991959086075940E+3  1.5730411891415534E+6
>   1.2254480396417496E+6  1.5350319889737575E+6  1.8962122985815424E+6
>   1.6150318076691339E+6  5.5913203238501656E+5  5.5913203238501656E+5
>   7.5015433968630666E+5  1.2254480396417496E+6  1.5350319889737575E+6
5034c5034
<   1.3165904011680067E+6  5.8619918176552828  5.8619918176552828
---
>   1.3165904011680067E+6  5.8619918176552819  5.8619918176552819
5036c5036
<   4.5585418860650151E+2  2.8891618719051439E+3  4.4349684715388783E+1
---
>   4.5585418860650151E+2  2.8891618719051389E+3  4.4349684715388776E+1
5038,5039c5038,5039
<   1.1554704575242921E+5  9.3273170044881073E+4  2.8219640108711734E+4
<   2.8219640108711734E+4  3.7860620150195391E+4  6.8465797627665073E+4
---
>   1.1554704575242921E+5  9.3273170044881073E+4  2.8219640108711781E+4
>   2.8219640108711781E+4  3.7860620150195457E+4  6.8465797627665073E+4
5237c5237
<   1.0540242066547204E+2  4.1870872388351614E+1  9.6606358743307351E+2
---
>   1.0540242066547194E+2  4.1870872388351614E+1  9.6606358743307339E+2
5239,5240c5239,5240
<   9.0396274311309571E+2  4.7291945715312482E+2  4.7291945715312482E+2
<   6.3448803244601186E+2  7.6156934668163262E+2  6.2316594042842530E+2
---
>   9.0396274311309571E+2  4.7291945715312522E+2  4.7291945715312522E+2
>   6.3448803244601231E+2  7.6156934668163262E+2  6.2316594042842530E+2
5245c5245
<   6.2016283283809298E+2  7.8498439571166762E+2  1.9539598133343732E+3
---
>   6.2016283283809298E+2  7.8498439571166762E+2  1.9539598133343729E+3
5248c5248
<   7.6161957665986835  1.2303969728888886E+1  2.8845690155186774
---
>   7.6161957665986835  1.2303969728888873E+1  2.8845690155186774
5250,5251c5250,5251
<   1.2679606076365255E+2  1.2510841764802268E+2  6.1186259228510103E+1
<   6.1186259228510103E+1  8.2089980954323451E+1  1.0366854707627922E+2
---
>   1.2679606076365255E+2  1.2510841764802268E+2  6.1186259228510160E+1
>   6.1186259228510160E+1  8.2089980954323522E+1  1.0366854707627922E+2
5449c5449
<   7.0320002812773935E+4  3.0991959086075940E+3  1.5730411891415534E+6
---
>   7.0320002812773819E+4  3.0991959086075940E+3  1.5730411891415534E+6
5451c5451
<   3.4585193557154422E+5  5.5913203238501586E+5  5.5913203238501586E+5
---
>   3.4585193557154422E+5  5.5913203238501656E+5  5.5913203238501656E+5
5458c5458
<   1.3165904011680067E+6  5.8619918176552828  5.8619918176552828
---
>   1.3165904011680067E+6  5.8619918176552819  5.8619918176552819
5460c5460
<   4.5585418860650151E+2  2.8891618719051439E+3  4.4349684715388783E+1
---
>   4.5585418860650151E+2  2.8891618719051389E+3  4.4349684715388776E+1
5462,5463c5462,5463
<   1.8428152636329232E+4  1.8428152636329232E+4  2.8219640108711734E+4
<   2.8219640108711734E+4  5.5284457908987693E+4  6.8465797627665073E+4
---
>   1.8428152636329232E+4  1.8428152636329232E+4  2.8219640108711781E+4
>   2.8219640108711781E+4  5.5284457908987693E+4  6.8465797627665073E+4
5661c5661
<   1.0540242066547204E+2  4.1870872388351614E+1  9.6606358743307351E+2
---
>   1.0540242066547194E+2  4.1870872388351614E+1  9.6606358743307339E+2
5663c5663
<   2.4873253717000517E+2  4.7291945715312482E+2  4.7291945715312482E+2
---
>   2.4873253717000517E+2  4.7291945715312522E+2  4.7291945715312522E+2
5669c5669
<   6.2016283283809298E+2  7.8498439571166762E+2  1.9539598133343732E+3
---
>   6.2016283283809298E+2  7.8498439571166762E+2  1.9539598133343729E+3
5672c5672
<   7.6161957665986835  1.2303969728888886E+1  2.8845690155186774
---
>   7.6161957665986835  1.2303969728888873E+1  2.8845690155186774
5674,5675c5674,5675
<   3.3065612070731476E+1  3.3065612070731476E+1  6.1186259228510103E+1
<   6.1186259228510103E+1  9.9196836212194412E+1  1.0366854707627922E+2
---
>   3.3065612070731476E+1  3.3065612070731476E+1  6.1186259228510160E+1
>   6.1186259228510160E+1  9.9196836212194412E+1  1.0366854707627922E+2
---------------------------------------
possible FAILURE:  check prmtop.NBFIX.dif
/scratch1/amber14/AmberTools/test/parmed/chamber_prmtop
5025,5028c5025,5028
<   7.0320002812773935E+4  3.0991959086075940E+3  1.5730411891415534E+6
<   1.2254480396417496E+6  1.5350319889737577E+6  1.8962122985815424E+6
<   1.6150318076691339E+6  5.5913203238501586E+5  5.5913203238501586E+5
<   7.5015433968630561E+5  1.2254480396417496E+6  1.5350319889737577E+6
---
>   7.0320002812773819E+4  3.0991959086075940E+3  1.5730411891415534E+6
>   1.2254480396417496E+6  1.5350319889737575E+6  1.8962122985815424E+6
>   1.6150318076691339E+6  5.5913203238501656E+5  5.5913203238501656E+5
>   7.5015433968630666E+5  1.2254480396417496E+6  1.5350319889737575E+6
5034c5034
<   1.3165904011680067E+6  5.8619918176552828  5.8619918176552828
---
>   1.3165904011680067E+6  5.8619918176552819  5.8619918176552819
5036c5036
<   4.5585418860650151E+2  2.8891618719051439E+3  4.4349684715388783E+1
---
>   4.5585418860650151E+2  2.8891618719051389E+3  4.4349684715388776E+1
5038,5039c5038,5039
<   1.1554704575242921E+5  9.3273170044881073E+4  2.8219640108711734E+4
<   2.8219640108711734E+4  3.7860620150195391E+4  6.8465797627665073E+4
---
>   1.1554704575242921E+5  9.3273170044881073E+4  2.8219640108711781E+4
>   2.8219640108711781E+4  3.7860620150195457E+4  6.8465797627665073E+4
5237c5237
<   1.0540242066547204E+2  4.1870872388351614E+1  9.6606358743307351E+2
---
>   1.0540242066547194E+2  4.1870872388351614E+1  9.6606358743307339E+2
5239,5240c5239,5240
<   9.0396274311309571E+2  4.7291945715312482E+2  4.7291945715312482E+2
<   6.3448803244601186E+2  7.6156934668163262E+2  6.2316594042842530E+2
---
>   9.0396274311309571E+2  4.7291945715312522E+2  4.7291945715312522E+2
>   6.3448803244601231E+2  7.6156934668163262E+2  6.2316594042842530E+2
5245c5245
<   6.2016283283809298E+2  7.8498439571166762E+2  1.9539598133343732E+3
---
>   6.2016283283809298E+2  7.8498439571166762E+2  1.9539598133343729E+3
5248c5248
<   7.6161957665986835  1.2303969728888886E+1  2.8845690155186774
---
>   7.6161957665986835  1.2303969728888873E+1  2.8845690155186774
5250,5251c5250,5251
<   1.2679606076365255E+2  1.2510841764802268E+2  6.1186259228510103E+1
<   6.1186259228510103E+1  8.2089980954323451E+1  1.0366854707627922E+2
---
>   1.2679606076365255E+2  1.2510841764802268E+2  6.1186259228510160E+1
>   6.1186259228510160E+1  8.2089980954323522E+1  1.0366854707627922E+2
5449c5449
<   7.0320002812773935E+4  3.0991959086075940E+3  1.5730411891415534E+6
---
>   7.0320002812773819E+4  3.0991959086075940E+3  1.5730411891415534E+6
5451c5451
<   3.4585193557154422E+5  5.5913203238501586E+5  5.5913203238501586E+5
---
>   3.4585193557154422E+5  5.5913203238501656E+5  5.5913203238501656E+5
5458c5458
<   1.3165904011680067E+6  5.8619918176552828  5.8619918176552828
---
>   1.3165904011680067E+6  5.8619918176552819  5.8619918176552819
5460c5460
<   4.5585418860650151E+2  2.8891618719051439E+3  4.4349684715388783E+1
---
>   4.5585418860650151E+2  2.8891618719051389E+3  4.4349684715388776E+1
5462,5463c5462,5463
<   1.8428152636329232E+4  1.8428152636329232E+4  2.8219640108711734E+4
<   2.8219640108711734E+4  5.5284457908987693E+4  6.8465797627665073E+4
---
>   1.8428152636329232E+4  1.8428152636329232E+4  2.8219640108711781E+4
>   2.8219640108711781E+4  5.5284457908987693E+4  6.8465797627665073E+4
5661c5661
<   1.0540242066547204E+2  4.1870872388351614E+1  9.6606358743307351E+2
---
>   1.0540242066547194E+2  4.1870872388351614E+1  9.6606358743307339E+2
5663c5663
<   2.4873253717000517E+2  4.7291945715312482E+2  4.7291945715312482E+2
---
>   2.4873253717000517E+2  4.7291945715312522E+2  4.7291945715312522E+2
5669c5669
<   6.2016283283809298E+2  7.8498439571166762E+2  1.9539598133343732E+3
---
>   6.2016283283809298E+2  7.8498439571166762E+2  1.9539598133343729E+3
5672c5672
<   7.6161957665986835  1.2303969728888886E+1  2.8845690155186774
---
>   7.6161957665986835  1.2303969728888873E+1  2.8845690155186774
5674,5675c5674,5675
<   3.3065612070731476E+1  3.3065612070731476E+1  6.1186259228510103E+1
<   6.1186259228510103E+1  9.9196836212194412E+1  1.0366854707627922E+2
---
>   3.3065612070731476E+1  3.3065612070731476E+1  6.1186259228510160E+1
>   6.1186259228510160E+1  9.9196836212194412E+1  1.0366854707627922E+2
---------------------------------------
possible FAILURE:  check prmtop.new_chg.dif
/scratch1/amber14/AmberTools/test/parmed/chamber_prmtop
5025,5028c5025,5028
<   7.0320002812773935E+4  3.0991959086075940E+3  1.5730411891415534E+6
<   1.2254480396417496E+6  1.5350319889737577E+6  1.8962122985815424E+6
<   1.6150318076691339E+6  5.5913203238501586E+5  5.5913203238501586E+5
<   7.5015433968630561E+5  1.2254480396417496E+6  1.5350319889737577E+6
---
>   7.0320002812773819E+4  3.0991959086075940E+3  1.5730411891415534E+6
>   1.2254480396417496E+6  1.5350319889737575E+6  1.8962122985815424E+6
>   1.6150318076691339E+6  5.5913203238501656E+5  5.5913203238501656E+5
>   7.5015433968630666E+5  1.2254480396417496E+6  1.5350319889737575E+6
5034c5034
<   1.3165904011680067E+6  5.8619918176552828  5.8619918176552828
---
>   1.3165904011680067E+6  5.8619918176552819  5.8619918176552819
5036c5036
<   4.5585418860650151E+2  2.8891618719051439E+3  4.4349684715388783E+1
---
>   4.5585418860650151E+2  2.8891618719051389E+3  4.4349684715388776E+1
5038,5039c5038,5039
<   1.1554704575242921E+5  9.3273170044881073E+4  2.8219640108711734E+4
<   2.8219640108711734E+4  3.7860620150195391E+4  6.8465797627665073E+4
---
>   1.1554704575242921E+5  9.3273170044881073E+4  2.8219640108711781E+4
>   2.8219640108711781E+4  3.7860620150195457E+4  6.8465797627665073E+4
5237c5237
<   1.0540242066547204E+2  4.1870872388351614E+1  9.6606358743307351E+2
---
>   1.0540242066547194E+2  4.1870872388351614E+1  9.6606358743307339E+2
5239,5240c5239,5240
<   9.0396274311309571E+2  4.7291945715312482E+2  4.7291945715312482E+2
<   6.3448803244601186E+2  7.6156934668163262E+2  6.2316594042842530E+2
---
>   9.0396274311309571E+2  4.7291945715312522E+2  4.7291945715312522E+2
>   6.3448803244601231E+2  7.6156934668163262E+2  6.2316594042842530E+2
5245c5245
<   6.2016283283809298E+2  7.8498439571166762E+2  1.9539598133343732E+3
---
>   6.2016283283809298E+2  7.8498439571166762E+2  1.9539598133343729E+3
5248c5248
<   7.6161957665986835  1.2303969728888886E+1  2.8845690155186774
---
>   7.6161957665986835  1.2303969728888873E+1  2.8845690155186774
5250,5251c5250,5251
<   1.2679606076365255E+2  1.2510841764802268E+2  6.1186259228510103E+1
<   6.1186259228510103E+1  8.2089980954323451E+1  1.0366854707627922E+2
---
>   1.2679606076365255E+2  1.2510841764802268E+2  6.1186259228510160E+1
>   6.1186259228510160E+1  8.2089980954323522E+1  1.0366854707627922E+2
5449c5449
<   7.0320002812773935E+4  3.0991959086075940E+3  1.5730411891415534E+6
---
>   7.0320002812773819E+4  3.0991959086075940E+3  1.5730411891415534E+6
5451c5451
<   3.4585193557154422E+5  5.5913203238501586E+5  5.5913203238501586E+5
---
>   3.4585193557154422E+5  5.5913203238501656E+5  5.5913203238501656E+5
5458c5458
<   1.3165904011680067E+6  5.8619918176552828  5.8619918176552828
---
>   1.3165904011680067E+6  5.8619918176552819  5.8619918176552819
5460c5460
<   4.5585418860650151E+2  2.8891618719051439E+3  4.4349684715388783E+1
---
>   4.5585418860650151E+2  2.8891618719051389E+3  4.4349684715388776E+1
5462,5463c5462,5463
<   1.8428152636329232E+4  1.8428152636329232E+4  2.8219640108711734E+4
<   2.8219640108711734E+4  5.5284457908987693E+4  6.8465797627665073E+4
---
>   1.8428152636329232E+4  1.8428152636329232E+4  2.8219640108711781E+4
>   2.8219640108711781E+4  5.5284457908987693E+4  6.8465797627665073E+4
5661c5661
<   1.0540242066547204E+2  4.1870872388351614E+1  9.6606358743307351E+2
---
>   1.0540242066547194E+2  4.1870872388351614E+1  9.6606358743307339E+2
5663c5663
<   2.4873253717000517E+2  4.7291945715312482E+2  4.7291945715312482E+2
---
>   2.4873253717000517E+2  4.7291945715312522E+2  4.7291945715312522E+2
5669c5669
<   6.2016283283809298E+2  7.8498439571166762E+2  1.9539598133343732E+3
---
>   6.2016283283809298E+2  7.8498439571166762E+2  1.9539598133343729E+3
5672c5672
<   7.6161957665986835  1.2303969728888886E+1  2.8845690155186774
---
>   7.6161957665986835  1.2303969728888873E+1  2.8845690155186774
5674,5675c5674,5675
<   3.3065612070731476E+1  3.3065612070731476E+1  6.1186259228510103E+1
<   6.1186259228510103E+1  9.9196836212194412E+1  1.0366854707627922E+2
---
>   3.3065612070731476E+1  3.3065612070731476E+1  6.1186259228510160E+1
>   6.1186259228510160E+1  9.9196836212194412E+1  1.0366854707627922E+2
---------------------------------------
possible FAILURE:  check final.prmtop.dif
/scratch1/amber14/AmberTools/test/parmed/chamber_prmtop
5025,5028c5025,5028
<   7.0320002812773935E+4  3.0991959086075940E+3  1.5730411891415534E+6
<   1.2254480396417496E+6  1.5350319889737577E+6  1.8962122985815424E+6
<   1.6150318076691339E+6  5.5913203238501586E+5  5.5913203238501586E+5
<   7.5015433968630561E+5  1.2254480396417496E+6  1.5350319889737577E+6
---
>   7.0320002812773819E+4  3.0991959086075940E+3  1.5730411891415534E+6
>   1.2254480396417496E+6  1.5350319889737575E+6  1.8962122985815424E+6
>   1.6150318076691339E+6  5.5913203238501656E+5  5.5913203238501656E+5
>   7.5015433968630666E+5  1.2254480396417496E+6  1.5350319889737575E+6
5034c5034
<   1.3165904011680067E+6  5.8619918176552828  5.8619918176552828
---
>   1.3165904011680067E+6  5.8619918176552819  5.8619918176552819
5036c5036
<   4.5585418860650151E+2  2.8891618719051439E+3  4.4349684715388783E+1
---
>   4.5585418860650151E+2  2.8891618719051389E+3  4.4349684715388776E+1
5038,5039c5038,5039
<   1.1554704575242921E+5  9.3273170044881073E+4  2.8219640108711734E+4
<   2.8219640108711734E+4  3.7860620150195391E+4  6.8465797627665073E+4
---
>   1.1554704575242921E+5  9.3273170044881073E+4  2.8219640108711781E+4
>   2.8219640108711781E+4  3.7860620150195457E+4  6.8465797627665073E+4
5237c5237
<   1.0540242066547204E+2  4.1870872388351614E+1  9.6606358743307351E+2
---
>   1.0540242066547194E+2  4.1870872388351614E+1  9.6606358743307339E+2
5239,5240c5239,5240
<   9.0396274311309571E+2  4.7291945715312482E+2  4.7291945715312482E+2
<   6.3448803244601186E+2  7.6156934668163262E+2  6.2316594042842530E+2
---
>   9.0396274311309571E+2  4.7291945715312522E+2  4.7291945715312522E+2
>   6.3448803244601231E+2  7.6156934668163262E+2  6.2316594042842530E+2
5245c5245
<   6.2016283283809298E+2  7.8498439571166762E+2  1.9539598133343732E+3
---
>   6.2016283283809298E+2  7.8498439571166762E+2  1.9539598133343729E+3
5248c5248
<   7.6161957665986835  1.2303969728888886E+1  2.8845690155186774
---
>   7.6161957665986835  1.2303969728888873E+1  2.8845690155186774
5250,5251c5250,5251
<   1.2679606076365255E+2  1.2510841764802268E+2  6.1186259228510103E+1
<   6.1186259228510103E+1  8.2089980954323451E+1  1.0366854707627922E+2
---
>   1.2679606076365255E+2  1.2510841764802268E+2  6.1186259228510160E+1
>   6.1186259228510160E+1  8.2089980954323522E+1  1.0366854707627922E+2
5449c5449
<   7.0320002812773935E+4  3.0991959086075940E+3  1.5730411891415534E+6
---
>   7.0320002812773819E+4  3.0991959086075940E+3  1.5730411891415534E+6
5451c5451
<   3.4585193557154422E+5  5.5913203238501586E+5  5.5913203238501586E+5
---
>   3.4585193557154422E+5  5.5913203238501656E+5  5.5913203238501656E+5
5458c5458
<   1.3165904011680067E+6  5.8619918176552828  5.8619918176552828
---
>   1.3165904011680067E+6  5.8619918176552819  5.8619918176552819
5460c5460
<   4.5585418860650151E+2  2.8891618719051439E+3  4.4349684715388783E+1
---
>   4.5585418860650151E+2  2.8891618719051389E+3  4.4349684715388776E+1
5462,5463c5462,5463
<   1.8428152636329232E+4  1.8428152636329232E+4  2.8219640108711734E+4
<   2.8219640108711734E+4  5.5284457908987693E+4  6.8465797627665073E+4
---
>   1.8428152636329232E+4  1.8428152636329232E+4  2.8219640108711781E+4
>   2.8219640108711781E+4  5.5284457908987693E+4  6.8465797627665073E+4
5661c5661
<   1.0540242066547204E+2  4.1870872388351614E+1  9.6606358743307351E+2
---
>   1.0540242066547194E+2  4.1870872388351614E+1  9.6606358743307339E+2
5663c5663
<   2.4873253717000517E+2  4.7291945715312482E+2  4.7291945715312482E+2
---
>   2.4873253717000517E+2  4.7291945715312522E+2  4.7291945715312522E+2
5669c5669
<   6.2016283283809298E+2  7.8498439571166762E+2  1.9539598133343732E+3
---
>   6.2016283283809298E+2  7.8498439571166762E+2  1.9539598133343729E+3
5672c5672
<   7.6161957665986835  1.2303969728888886E+1  2.8845690155186774
---
>   7.6161957665986835  1.2303969728888873E+1  2.8845690155186774
5674,5675c5674,5675
<   3.3065612070731476E+1  3.3065612070731476E+1  6.1186259228510103E+1
<   6.1186259228510103E+1  9.9196836212194412E+1  1.0366854707627922E+2
---
>   3.3065612070731476E+1  3.3065612070731476E+1  6.1186259228510160E+1
>   6.1186259228510160E+1  9.9196836212194412E+1  1.0366854707627922E+2
---------------------------------------
possible FAILURE:  check md3_cpout.pH_4.50.dif
/scratch1/amber14/AmberTools/test/cphstats
2056,2100c2056
< Residue    2 State:  0
< Residue    0 State:  3
< Residue    4 State:  0
< Residue    8 State:  3
< Residue    7 State:  0
< Residue    9 State:  0
< Residue    7 State:  0
< Residue    3 State:  3
< Residue    8 State:  0
< Residue    7 State:  0
< Residue    6 State:  0
< Residue    0 State:  3
< Residue    5 State:  3
< Residue    2 State:  0
< Residue    1 State:  0
< Residue    5 State:  3
< Residue    1 State:  0
< Residue    3 State:  1
< Residue    9 State:  0
< Residue    6 State:  0
< Residue    9 State:  0
< Residue    2 State:  0
< Residue    7 State:  0
< Residue    3 State:  3
< Residue    0 State:  0
< Residue    3 State:  3
< Residue    2 State:  0
< Residue    4 State:  0
< Residue    2 State:  0
< Residue    0 State:  3
< Residue    5 State:  0
< Residue    3 State:  1
< Residue    1 State:  0
< Residue    2 State:  3
< Residue    8 State:  0
< Residue    4 State:  0
< Residue    8 State:  2
< Residue    2 State:  0
< Residue    1 State:  1
< Residue    9 State:  0
< Residue    2 State:  0
< Residue    4 State:  0
< Residue    3 State:  3
< Residue    9 State:  0
< Residue    6 State:  0
---
> Res
\ No newline at end of file
---------------------------------------
possible FAILURE:  check pH_2.00.calcpka.dif
/scratch1/amber14/AmberTools/test/cphstats
---------------------------------------
possible FAILURE:  check pH_2.50.calcpka.dif
/scratch1/amber14/AmberTools/test/cphstats
---------------------------------------
possible FAILURE:  check pH_3.00.calcpka.dif
/scratch1/amber14/AmberTools/test/cphstats
---------------------------------------
possible FAILURE:  check pH_3.50.calcpka.dif
/scratch1/amber14/AmberTools/test/cphstats
---------------------------------------
possible FAILURE:  check pH_4.00.calcpka.dif
/scratch1/amber14/AmberTools/test/cphstats
---------------------------------------
possible FAILURE:  check pH_4.50.calcpka.dif
/scratch1/amber14/AmberTools/test/cphstats
---------------------------------------
possible FAILURE:  check pH_6.00.calcpka.dif
/scratch1/amber14/AmberTools/test/cphstats
4c4
< AS4 18  : Offset   -inf  Pred   -inf  Frac Prot 0. Transitions         0
> AS4 18  : Offset -3.592  Pred  2.408  Frac Prot 0. Transitions         1
---------------------------------------
possible FAILURE:  check pH_7.50.calcpka.dif
/scratch1/amber14/AmberTools/test/cphstats
5c5
< GL4 35  : Offset -2.116  Pred  5.384  Frac Prot 0.008 Transitions         6
> GL4 35  : Offset -2.360  Pred  5.140  Frac Prot 0.004 Transitions         4
9c9
< AS4 87  : Offset   -inf  Pred   -inf  Frac Prot 0. Transitions         0
> AS4 87  : Offset -3.592  Pred  3.908  Frac Prot 0. Transitions         1
12c12
< Average total molecular protonation:   1.026
> Average total molecular protonation: -27296.974
### Maximum absolute error in matching lines = 2.73e+04 at line 12 field 5
### Maximum relative error in matching lines = 2.66e+04 at line 12 field 5
---------------------------------------
possible FAILURE:  check pH_2.00.calcpka.dif
/scratch1/amber14/AmberTools/test/cphstats
---------------------------------------
possible FAILURE:  check running_avgs.dat.dif
/scratch1/amber14/AmberTools/test/cphstats
---------------------------------------
possible FAILURE:  check running_avg.dat.dif
/scratch1/amber14/AmberTools/test/cphstats
---------------------------------------
possible FAILURE:  check running_pKa.dat.dif
/scratch1/amber14/AmberTools/test/cphstats
---------------------------------------
possible FAILURE:  check chunk.dat.dif
/scratch1/amber14/AmberTools/test/cphstats
---------------------------------------
possible FAILURE:  check chunk_deprot.dat.dif
/scratch1/amber14/AmberTools/test/cphstats
---------------------------------------
possible FAILURE:  check chunk_pka.dat.dif
/scratch1/amber14/AmberTools/test/cphstats
---------------------------------------
possible FAILURE:  check cumulative.dat.dif
/scratch1/amber14/AmberTools/test/cphstats
---------------------------------------
possible FAILURE:  check cumulative_deprot.dat.dif
/scratch1/amber14/AmberTools/test/cphstats
---------------------------------------
possible FAILURE:  check cumulative_pka.dat.dif
/scratch1/amber14/AmberTools/test/cphstats
---------------------------------------
possible FAILURE:  check pop.dat.dif
/scratch1/amber14/AmberTools/test/cphstats
---------------------------------------
possible FAILURE:  check conditional.dat.dif
/scratch1/amber14/AmberTools/test/cphstats
---------------------------------------
possible FAILURE:  check conditional_chunks.dat.dif
/scratch1/amber14/AmberTools/test/cphstats
---------------------------------------
