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Application

Discovery Studio 0.8423113556990157 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06719865602687947 Amorphous Cell 0.29007419851602967 Blends 0.002239955200895982 CASTEP 0.3856922861542769 CDOCKER 0.14755704885902282 CHARMm 0.23589528209435812 COMPASS 0.3634327313453731 COMPASS III 0.09505809883802324 COSMObase 0.003919921601567969 COSMOconf 0.0055998880022399555 COSMOmic 0.0 COSMOperm 8.399832003359933E-4 COSMOplex 2.799944001119978E-4 COSMOquick 0.00125997480050399 COSMOtherm 0.06859862802743945 Cantera 0.0 Catalyst 0.09141817163656726 Classical Simulations 1.0 Conformers 4.1999160016799666E-4 Crystallization 0.07391852162956741 DFTB Plus 0.005879882402351953 DMol3 0.16939661206775863 DPD 0.002379952400951981 Discover 0.003639927201455971 Forcite 0.5508889822203555 GULP 0.021139577208455832 Kinetix 2.799944001119978E-4 LUDI 0.003639927201455971 LibDock 0.0624387512249755 LigandFit 0.0037799244015119695 MCSS 5.599888002239956E-4 MODELER 0.20187596248075038 MesoDyn 8.399832003359933E-4 Mesocite 0.0029399412011759767 Mesoscale 0.005739885202295954 Modules 0.0 Morphology 0.017359652806943862 ONETEP 0.001119977600447991 Polymorph 0.0020999580008399833 QMERA 1.399972000559989E-4 QSAR 9.799804003919922E-4 Quantum Mechanics 0.5444491110177796 Reflex 0.05333893322133557 Reflex Plus 8.399832003359933E-4 Semi-empirical 0.00741985160296794 Sorption 0.05823883522329554 Synthia 0.0013999720005599889 TURBOMOLE 5.599888002239956E-4 VAMP 0.001119977600447991 Visualization 0.6987260254794904 X-Cell 0.0013999720005599889 ZDOCK 0.025479490410191798

Year

2022 0.0 2023 0.14747452613125892 2024 0.45885833242029145 2025 1.0 2026 0.4664183192724882 2027 8.765202147474527E-4

Keywords

target 1.0 potential 0.2835054937824857 analysis 0.19521021119810514 docking 0.19297322192249491 visualization 0.1638923613395618 between 0.1580367129416409 energy 0.09599315744456872 novel 0.09342719915783933 promising 0.0707283373906178 cell 0.0668465030594118 binding 0.058030133561418513 performance 0.045529311138890714 activity 0.04125271399434173 stability 0.03960786893874597 experimental 0.02940982959405224 synthesized 0.022830449371669188 interaction 0.02079084150273044 including 0.02046187249161129 effective 0.018422264622672543 mechanism 0.016053687742614647 development 0.015987893940390817 enhanced 0.009276926113560102 design 0.002960721100072373 synthesis 7.237318244621356E-4 strong 0.0
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