fix spelling
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@ -168,9 +168,9 @@ length of the fingerprint vector is m*k.
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*screening* specifies the Cmax and Cmin values used in the screening fingerprints. Neighbors' contribution to the
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*screening* specifies the Cmax and Cmin values used in the screening fingerprints. Neighbors' contribution to the
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fingerprint are ommitted if they are blocked by a closer neighbor, and reduced if they are partially blocked.
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fingerprint are omitted if they are blocked by a closer neighbor, and reduced if they are partially blocked.
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Larger values of Cmin correspond to neighbors being blocked more easily. Cmax cannot be greater than 3, and
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Larger values of Cmin correspond to neighbors being blocked more easily. Cmax cannot be greater than 3, and
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Cmin cannot be greater than Cmax or less than zero. Screening may be ommitted in which case the default values
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Cmin cannot be greater than Cmax or less than zero. Screening may be omitted in which case the default values
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Cmax = 2.8, Cmin = 0.8 are used. Since screening is a bond computation, it is specified separately for each
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Cmax = 2.8, Cmin = 0.8 are used. Since screening is a bond computation, it is specified separately for each
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combination of three elements in which the latter two may be interchanged with no effect.
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combination of three elements in which the latter two may be interchanged with no effect.
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