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Application

Discovery Studio 1.0 Materials Studio 0.9639029892837 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06669772497864741 Amorphous Cell 0.2770401428682351 Blends 0.002639956518363227 CASTEP 0.4074850531873593 CDOCKER 0.17943939746874757 CHARMm 0.26213215311747806 COMPASS 0.36796335119186274 COMPASS III 0.07453994875378524 COSMObase 0.0029505396381706655 COSMOconf 0.0034164143178818233 COSMOmic 2.3293733985557886E-4 COSMOperm 0.0013199782591816135 COSMOplex 3.1058311980743846E-4 COSMOquick 0.001397624039133473 COSMOtherm 0.06405776846028419 Cantera 7.764577995185961E-5 Catalyst 0.12415560214302353 Classical Simulations 1.0 Conformers 0.0013199782591816135 Crystallization 0.07485053187359267 DFTB Plus 0.00597872505629319 DMol3 0.18603928876465564 DPD 0.0029505396381706655 Discover 0.0045034552372078575 Forcite 0.5307865517509124 GULP 0.02639956518363227 Kinetix 2.3293733985557886E-4 LUDI 0.005901079276341331 LibDock 0.0722882211351813 LigandFit 0.007686932215234102 MCSS 0.001397624039133473 MODELER 0.19155213914123767 MesoDyn 0.0017858529388927711 Mesocite 0.0038822889975929807 Mesoscale 0.007609286435282242 Modules 0.0 Morphology 0.017547946269120273 ONETEP 9.317493594223154E-4 Polymorph 0.0018634987188446308 QMERA 2.3293733985557886E-4 QSAR 0.0013199782591816135 Quantum Mechanics 0.5813339544995729 Reflex 0.055128503765820326 Reflex Plus 6.988120195667365E-4 Semi-empirical 0.00799751533504154 Sorption 0.05450733752620545 Synthia 0.001397624039133473 TURBOMOLE 6.211662396148769E-4 VAMP 0.001630561378989052 Visualization 0.8937029272459042 X-Cell 0.0010870409193260346 ZDOCK 0.03020420840127339

Year

2020 0.04806934594168637 2021 0.14849838017686717 2022 0.29375711408808336 2023 0.4553016373347343 2024 0.9470274056562472 2025 1.0 2026 0.37220908852114526 2027 0.0

Keywords

target 1.0 potential 0.2622747857817743 docking 0.2180953311830059 visualization 0.21483725930994038 analysis 0.17857491936272113 between 0.1491545303489395 novel 0.09976216075326622 energy 0.08008340663995048 binding 0.07030919102075392 cell 0.05633206268530284 activity 0.05278076434366142 promising 0.04287622584954224 interaction 0.03785879516502134 synthesized 0.027791353077248886 experimental 0.02674877007786792 stability 0.02456586192291402 protein 0.019841657706969017 mechanism 0.016811650865018082 effective 0.014661323428794839 development 0.014628742710064185 performance 0.013716482585605838 synthesis 0.011696478024305216 including 0.007721630339165282 chemical 0.0016941973739940702 design 0.0
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