Anubhav Goswami
@anubhav00.bsky.social
Grad student in computational chemistry. Into movies, food, and science.
Neither, now you have a first-person perspective on how helpful people find your blog!
November 10, 2025 at 9:30 PM
Neither, now you have a first-person perspective on how helpful people find your blog!
@marcelswart.bsky.social this is... interesting
November 7, 2025 at 6:44 PM
@marcelswart.bsky.social this is... interesting
It's a pity that we'll have to wait 24 more years to see it...
October 17, 2025 at 1:37 AM
It's a pity that we'll have to wait 24 more years to see it...
Nice!
I'm curious:
1) how long did it take you?
2) how much would it have cost if you failed after taking it all apart?
I'm curious:
1) how long did it take you?
2) how much would it have cost if you failed after taking it all apart?
August 22, 2025 at 1:00 AM
Nice!
I'm curious:
1) how long did it take you?
2) how much would it have cost if you failed after taking it all apart?
I'm curious:
1) how long did it take you?
2) how much would it have cost if you failed after taking it all apart?
Molecular Science Building, UCLA!
August 7, 2025 at 2:19 AM
Molecular Science Building, UCLA!
Are both (local) minimum structures on the PES?
I feel maybe RMSD is not the best metric here? As an extreme case, if I have a huge molecule and distort just one bond artificially, destabilizing the molecule overall, it may still have a low RMSD due to the sheer size of the molecule.
I feel maybe RMSD is not the best metric here? As an extreme case, if I have a huge molecule and distort just one bond artificially, destabilizing the molecule overall, it may still have a low RMSD due to the sheer size of the molecule.
July 30, 2025 at 8:39 PM
Are both (local) minimum structures on the PES?
I feel maybe RMSD is not the best metric here? As an extreme case, if I have a huge molecule and distort just one bond artificially, destabilizing the molecule overall, it may still have a low RMSD due to the sheer size of the molecule.
I feel maybe RMSD is not the best metric here? As an extreme case, if I have a huge molecule and distort just one bond artificially, destabilizing the molecule overall, it may still have a low RMSD due to the sheer size of the molecule.
Wow, this is very cool!
June 18, 2025 at 5:02 PM
Wow, this is very cool!
Really enjoyed reading this!
May 7, 2025 at 5:49 PM
Really enjoyed reading this!
Fun and very satisfying to read!
November 17, 2024 at 2:15 AM
Fun and very satisfying to read!
also @gagliardilaura.bsky.social @joaquinbarroso.bsky.social @limmerlab.bsky.social @cisnerosres.bsky.social @ltchong.bsky.social
November 16, 2024 at 4:59 PM