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3 Commits
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9c7be61644 | ||
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f05cdb7cdd | ||
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5ef19079e9 |
@@ -607,7 +607,7 @@ void write_pocket_pdb(const char out[], s_pocket *pocket) {
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fprintf(f, "HEADER 7 - Polarity Score : %5d\n", pocket->pdesc->polarity_score);
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fprintf(f, "HEADER 8 - Amino Acid based volume Score : %.4f\n", pocket->pdesc->volume_score);
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fprintf(f, "HEADER 9 - Pocket volume (Monte Carlo) : %.4f\n", pocket->pdesc->volume);
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fprintf(f, "HEADER 10 -Pocket volume (convex hull) : %.4f\n", pocket->pdesc->convex_hull_volume);
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fprintf(f, "HEADER 10 - Pocket volume (convex hull) : %.4f\n", pocket->pdesc->convex_hull_volume);
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fprintf(f, "HEADER 11 - Charge Score : %5d\n", pocket->pdesc->charge_score);
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fprintf(f, "HEADER 12 - Local hydrophobic density Score : %.4f\n", pocket->pdesc->mean_loc_hyd_dens);
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fprintf(f, "HEADER 13 - Number of apolar alpha sphere : %5d\n", pocket->nAlphaApol);
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