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Application

Discovery Studio 0.8569827931172469 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0686612139474817 Amorphous Cell 0.2879896685320706 Blends 0.0024752475247524753 CASTEP 0.4003443822643134 CDOCKER 0.14905294877313818 CHARMm 0.23611708996986655 COMPASS 0.3704261730520878 COMPASS III 0.08663366336633663 COSMObase 0.003659061558329746 COSMOconf 0.004520017219113216 COSMOmic 1.0761945759793371E-4 COSMOperm 0.0011838140335772708 COSMOplex 2.1523891519586742E-4 COSMOquick 0.0013990529487731382 COSMOtherm 0.06500215238915195 Cantera 0.0 Catalyst 0.10460611278519157 Classical Simulations 1.0 Conformers 7.53336203185536E-4 Crystallization 0.07479552303056393 DFTB Plus 0.005703831252690486 DMol3 0.17843306069737408 DPD 0.0027981058975462764 Discover 0.0037666810159276798 Forcite 0.5532716315109771 GULP 0.02410675850193715 Kinetix 2.1523891519586742E-4 LUDI 0.0032285837279380112 LibDock 0.06252690486439948 LigandFit 0.004842875591907016 MCSS 4.3047783039173483E-4 MODELER 0.1902712010331468 MesoDyn 8.609556607834697E-4 Mesocite 0.003659061558329746 Mesoscale 0.00667240637107189 Modules 0.0 Morphology 0.017541971588463195 ONETEP 0.0011838140335772708 Polymorph 0.0020447696943607404 QMERA 2.1523891519586742E-4 QSAR 9.685751183814034E-4 Quantum Mechanics 0.5675850193715024 Reflex 0.05456306500215239 Reflex Plus 9.685751183814034E-4 Semi-empirical 0.0075333620318553595 Sorption 0.057145931984502796 Synthia 0.0013990529487731382 TURBOMOLE 5.380972879896685E-4 VAMP 0.0013990529487731382 Visualization 0.7336418424451141 X-Cell 0.001506672406371072 ZDOCK 0.02615152819629789

Year

2022 0.025268477574226154 2023 0.23057485786481363 2024 0.6187167223174803 2025 1.0 2026 0.383539391751647 2027 0.0

Keywords

target 1.0 potential 0.27808171915816454 docking 0.19582039528808715 analysis 0.19296170338607127 visualization 0.17413376706589778 between 0.15934742964167775 energy 0.09709694908571147 novel 0.09620976884025827 cell 0.06550347478929469 promising 0.06308837301000542 binding 0.061708314850411554 activity 0.04273251515599586 performance 0.04012026221105032 stability 0.04012026221105032 experimental 0.03154418650500271 interaction 0.028882645768643106 synthesized 0.02627039282369757 effective 0.020405145645423627 mechanism 0.019517965399970427 including 0.01749716595199369 development 0.016560697915126422 synthesis 0.004633052392922273 protein 0.002809404110601804 design 3.450145398984672E-4 enhanced 0.0
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