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Application

Discovery Studio 0.7664331896551724 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06486201441378098 Amorphous Cell 0.2968887326419406 Blends 0.0019335559852346634 CASTEP 0.36122341360520305 CDOCKER 0.13851291966953772 CHARMm 0.22657760590613465 COMPASS 0.3621023026894006 COMPASS III 0.10669713482158552 COSMObase 0.004570223237827386 COSMOconf 0.00544911232202496 COSMOmic 1.7577781683951485E-4 COSMOperm 8.788890841975743E-4 COSMOplex 1.7577781683951485E-4 COSMOquick 0.0015820003515556336 COSMOtherm 0.06767445948321321 Catalyst 0.06872912638425031 Classical Simulations 1.0 Conformers 3.515556336790297E-4 Crystallization 0.07470557215679381 DFTB Plus 0.003691334153629812 DMol3 0.16435225874494638 DPD 0.002285111618913693 Discover 0.003691334153629812 Forcite 0.5586219019159782 GULP 0.02056600457022324 Kinetix 1.7577781683951485E-4 LUDI 0.0028124450694322375 LibDock 0.05941290209175602 LigandFit 0.0028124450694322375 MCSS 0.0 MODELER 0.21357004746001054 MesoDyn 7.031112673580594E-4 Mesocite 0.0031640007031112673 Mesoscale 0.005800667955703991 Modules 0.0 Morphology 0.017577781683951486 ONETEP 8.788890841975743E-4 Polymorph 0.0019335559852346634 QMERA 1.7577781683951485E-4 QSAR 7.031112673580594E-4 Quantum Mechanics 0.5146774477060995 Reflex 0.054139567586570576 Reflex Plus 0.0012304447178766039 Semi-empirical 0.005273334505185446 Sorption 0.05818245737387941 Synthia 0.0014062225347161188 TURBOMOLE 1.7577781683951485E-4 VAMP 0.001054666901037089 Visualization 0.6106521357004746 X-Cell 0.0015820003515556336 ZDOCK 0.023378449639655477

Year

2023 3.965107057890563E-4 2024 0.32765001321702353 2025 1.0 2026 0.5594766058683585 2027 0.0

Keywords

target 1.0 potential 0.28099973598521516 analysis 0.19871512804717065 docking 0.17196162985127167 between 0.1563847575464226 visualization 0.13605561911467043 energy 0.10085364780427704 novel 0.08703687406494763 promising 0.07964446008976503 cell 0.07119598697527062 performance 0.060723400510428585 binding 0.05271495203731409 stability 0.0468186218428232 activity 0.02851359676141864 experimental 0.026137463697967087 including 0.021033177857960047 effective 0.01865704479450849 enhanced 0.01760098565519669 mechanism 0.01601689694622899 synthesized 0.012672709671741618 interaction 0.011616650532429816 development 0.011352635747601866 strong 0.0052802956965590075 design 0.0029921675613834376 strategy 0.0
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