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Application

Discovery Studio 1.0 Materials Studio 0.9894800120228434 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.060093023255813956 Amorphous Cell 0.282046511627907 Blends 0.0022325581395348836 CASTEP 0.33469767441860465 CDOCKER 0.170046511627907 CHARMm 0.2688372093023256 COMPASS 0.3386046511627907 COMPASS III 0.10418604651162791 COSMObase 0.004651162790697674 COSMOconf 0.005953488372093023 COSMOmic 0.0 COSMOperm 3.7209302325581393E-4 COSMOplex 1.8604651162790697E-4 COSMOquick 0.0011162790697674418 COSMOtherm 0.06455813953488372 Catalyst 0.08446511627906977 Classical Simulations 1.0 Conformers 3.7209302325581393E-4 Crystallization 0.07106976744186047 DFTB Plus 0.0037209302325581397 DMol3 0.1514418604651163 DPD 0.002046511627906977 Discover 0.0037209302325581397 Forcite 0.5255813953488372 GULP 0.01972093023255814 Kinetix 1.8604651162790697E-4 LUDI 0.0037209302325581397 LibDock 0.07181395348837209 LigandFit 0.004093023255813954 MCSS 3.7209302325581393E-4 MODELER 0.2565581395348837 MesoDyn 5.581395348837209E-4 Mesocite 0.0027906976744186047 Mesoscale 0.005209302325581395 Modules 0.0 Morphology 0.016 ONETEP 9.302325581395349E-4 Polymorph 0.002046511627906977 QMERA 1.8604651162790697E-4 QSAR 5.581395348837209E-4 Quantum Mechanics 0.4766511627906977 Reflex 0.05190697674418605 Reflex Plus 7.441860465116279E-4 Semi-empirical 0.005395348837209302 Sorption 0.05748837209302326 Synthia 0.0011162790697674418 TURBOMOLE 1.8604651162790697E-4 VAMP 0.0011162790697674418 Visualization 0.7198139534883721 X-Cell 0.0014883720930232557 ZDOCK 0.029953488372093023

Year

2023 1.4997000599880023E-4 2024 0.5064487102579485 2025 1.0 2026 0.635122975404919 2027 0.0

Keywords

target 1.0 potential 0.3032577028339366 docking 0.22035843559636267 analysis 0.2140902268914982 visualization 0.16809393484594332 between 0.14681733910126246 novel 0.09693652335128454 promising 0.08157499779288425 energy 0.07557164297695772 binding 0.0718636885318266 cell 0.06206409464112298 activity 0.04970424649068597 stability 0.039021806303522553 performance 0.03699125982166505 including 0.02127659574468085 synthesized 0.01624437185486007 effective 0.01615608722521409 mechanism 0.01544981018804626 development 0.015273240928754303 experimental 0.01492010241017039 interaction 0.010682440187163415 enhanced 0.008475324446013949 protein 0.004767370000882847 strong 0.004325946852652953 design 0.0
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