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PubPharm (206)
1
Advances in machine learning with chemical language models in molecular property and reaction outcome predictions
enthalten in:
Journal of computational chemistry
| 2024
von
Das, M.
|
Ghosh, A.
|
Sunoj, R.
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2
Combinatorial Ligand Assisted Simultaneous Control of Axial and Central Chirality in Highly Stereoselective C-H Allylation
enthalten in:
Angewandte Chemie (International ed. in English)
| 2024
von
Bhattacharya, T.
|
Ghosh, S.
|
Dutta, S.
| +5
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3
Combinatorial Ligand Assisted Simultaneous Control of Axial and Central Chirality in Highly Stereoselective C−H Allylation
enthalten in:
Angewandte Chemie
| 2024
von
Bhattacharya, T.
|
Ghosh, S.
|
Dutta, S.
| +5
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4
Combinatorial Ligand Assisted Simultaneous Control of Axial and Central Chirality in Highly Stereoselective C−H Allylation
enthalten in:
Angewandte Chemie International Edition
| 2024
von
Bhattacharya, T.
|
Ghosh, S.
|
Dutta, S.
| +5
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5
Advances in machine learning with chemical language models in molecular property and reaction outcome predictions
enthalten in:
Journal of Computational Chemistry
| 2024
von
Das, M.
|
Ghosh, A.
|
Sunoj, R.
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6
Recent Applications of Machine Learning in Molecular Property and Chemical Reaction Outcome Predictions
enthalten in:
The journal of physical chemistry. A
| 2023
von
Shilpa, S.
|
Kashyap, G.
|
Sunoj, R.
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7
Role of Noncovalent Interactions in Inducing High Enantioselectivity in an Alcohol Reductive Deoxygenation Reaction Involving a Planar Carbocationic Intermediate
enthalten in:
Journal of the American Chemical Society
| 2023
von
Ghosh, S.
|
Changotra, A.
|
Petrone, D.
| +3
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8
Molecular Machine Learning for Chemical Catalysis : Prospects and Challenges
enthalten in:
Accounts of chemical research
| 2023
von
Singh, S.
|
Sunoj, R.
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9
An iron(ii)-based metalloradical system for intramolecular amination of C(sp2)-H and C(sp3)-H bonds : synthetic applications and mechanistic studies
enthalten in:
Chemical science
| 2022
von
Das, S.
|
Das, S.
|
Ghosh, S.
| +5
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10
A transfer learning approach for reaction discovery in small data situations using generative model
enthalten in:
iScience
| 2022
von
Singh, S.
|
Sunoj, R.
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4
density functional calculations
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3
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3
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3
asymmetric catalysis
3
bidentate phosphine
3
hydrogenase enzyme
3
proton reduction
3
redox active ligands
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2020-
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2010-2019
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