Date: Thu, 26 Oct 2023 22:42:20 +0000
Dear all, I am getting this error message but i am not entirely sure why and how to fix it.
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1. RESOURCE USE:
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| Flags:
getting new box info from bottom of inpcrd
| INFO: Old style inpcrd file read
peek_ewald_inpcrd: SHOULD NOT BE HERE
190.0000 190.0000 190.0000 90.0000 90.0000 90.0000
This is the last few lines of the rst7 file
189.0290070 191.1210022 79.3610001 188.1759949 191.1479950 79.8539963
188.8079987 191.7709961 78.6460037 190.8939972 190.2449951 81.1250000
190.2180023 190.6580048 80.5289993 191.4479980 189.8049927 80.4459991
191.0240021 189.3040009 78.3399963 191.5279999 189.6609955 77.5770035
190.3419952 189.9940033 78.4469986 194.8569946 188.6029968 81.9499969
194.8750000 189.5509949 82.1880035 194.8220062 188.2039948 82.8570023
192.5800018 190.2070007 76.1800003 193.1390076 189.5899963 75.6569977
193.2859955 190.7169952 76.6439972 197.0240021 192.2440033 78.1320038
197.4010010 191.6999969 78.8679962 196.9949951 193.1179962 78.5989990
190.0000000 190.0000000 190.0000000 90.0000000 90.0000000 90.0000000
And i've checked that there are no empty lines after rst7.
Any advice would be appreciated. Thanks!
Regards,
Xavier Chee
[cid:8d84cebd-8266-44cb-9817-57ebcb153567]
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