One by one the interactions with the cavity were calculated
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Joaquin Barroso Flores is a member of Chemistry on Mendeley.
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Quite a useful function! Thank you for posting. Is there a way to further print out the energy and t
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Good job! Your posts are always helpful and this one is just remarkable. Using this opportunity to r
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Thank you very much, I find it very useful for my future research
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[…] fragment=n label in the coordinates can be used as in BSSE Counterpoise calculations and t
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Very interesting and insightful review
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Ho can we make input file on Gaussian to check spin contamination
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Greetings. I do not understand how the higher LUMO+1 orbital will be the acceptor while the lower en
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hi dear Dr, I am a drug delivery and drug discovery researcher and working on finding the intermolec
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