Sent to CCL by: "Olawale Lukman Olasunkanmi" [waleolasunkanmi|,|gmail.com]
I appreciate your earlier contributions while I was getting started.
Please, how do I correct the following errors emanating from or stopping my calculations:
1. the gradient norm is too high for force field calculations
2. the gradient norm is too high, results may be inaccurate
Can you suggest a molecular builder that I can readily download and use to generate my input file?
Thank you in anticipation of your responses.
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