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Application

Discovery Studio 0.9096129837702871 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0687960687960688 Amorphous Cell 0.2838261458951114 Blends 0.0033042446835550286 CASTEP 0.4168431754638651 CDOCKER 0.163433025501991 CHARMm 0.2415487587901381 COMPASS 0.37990341438617303 COMPASS III 0.07709904261628399 COSMObase 0.003219520460899771 COSMOconf 0.003727865796831314 COSMOmic 1.694484453105143E-4 COSMOperm 0.0013555875624841143 COSMOplex 3.388968906210286E-4 COSMOquick 0.0016097602304498855 COSMOtherm 0.0664237905617216 Cantera 0.0 Catalyst 0.10768448699483182 Classical Simulations 1.0 Conformers 0.0013555875624841143 Crystallization 0.07625180038973142 DFTB Plus 0.005930695585868 DMol3 0.1893586376344997 DPD 0.003219520460899771 Discover 0.004914004914004914 Forcite 0.545962890790477 GULP 0.026179784800474455 Kinetix 1.694484453105143E-4 LUDI 0.004829280691349657 LibDock 0.06523765144454799 LigandFit 0.006862662035075828 MCSS 0.0010166906718630856 MODELER 0.19122257053291536 MesoDyn 0.001270863339828857 Mesocite 0.004575108023383886 Mesoscale 0.008133525374904685 Modules 0.0 Morphology 0.01813098364822503 ONETEP 0.0011861391171736 Polymorph 0.0021181055663814286 QMERA 1.694484453105143E-4 QSAR 0.0014403117851393714 Quantum Mechanics 0.5939168008133525 Reflex 0.05549436583919343 Reflex Plus 8.472422265525714E-4 Semi-empirical 0.0077099042616283996 Sorption 0.05430822672201983 Synthia 0.0011861391171736 TURBOMOLE 5.083453359315428E-4 VAMP 0.0014403117851393714 Visualization 0.7984410743031433 X-Cell 0.001270863339828857 ZDOCK 0.02762009658561383

Year

2020 0.04140493674245775 2021 0.1345660444129877 2022 0.15394143147836858 2023 0.4325400336193931 2024 0.7754578430505176 2025 1.0 2026 0.3760063699902681 2027 0.0

Keywords

target 1.0 potential 0.2568753007365733 docking 0.1960247251730392 visualization 0.1882888551652663 analysis 0.17666654328755968 between 0.15301476847910575 novel 0.09434800310915349 energy 0.08827775104563793 cell 0.06159085020542621 binding 0.06025835585002036 promising 0.04793278306251619 activity 0.04582300033312359 interaction 0.03279416663582189 experimental 0.03049931524595625 stability 0.02924084835473961 synthesized 0.024429063182440685 performance 0.022319280453048082 mechanism 0.017470481548654552 effective 0.015804863604397233 development 0.012658696376355628 including 0.007957952400340527 protein 0.00766184254358367 synthesis 0.006070252063515564 chemical 0.0012584668912166415 design 0.0
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